Similar Compounds for PubChem Compound (Select 40952) - PubChem Compound - NCBI

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Select item 409521.

an image of a chemical structure CID 40952

BARBITURIC ACID, 5-BUTYL-5-ISOPROPYL-; 53943-63-8; n-Butylisopropylbarbituric acid ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-butyl-5-propan-2-yl-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-26

CID:: 40952

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 216001332.

an image of a chemical structure CID 21600133

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-pentan-2-yl-5-propan-2-yl-1,3-diazinane-2,4,6-trione

Create Date:: 2007-12-05

CID:: 21600133

Summary Similar Compounds Same Parent, Connectivity

Select item 128300983.

an image of a chemical structure CID 12830098

Diberal, (-)-; (-)-DMBB; UNII-ZKZ077N71R ...

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-ethyl-5-[(2S)-4-methylpentan-2-yl]-1,3-diazinane-2,4,6-tri...

Create Date:: 2007-02-08

CID:: 12830098

Summary Similar Compounds Same Parent, Connectivity

Select item 128300974.

an image of a chemical structure CID 12830097

Diberal, (+)-; (+)-DMBB; UNII-K6Q23CUT4O ...

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-ethyl-5-[(2R)-4-methylpentan-2-yl]-1,3-diazinane-2,4,6-tri...

Create Date:: 2007-02-08

CID:: 12830097

Summary Similar Compounds Same Parent, Connectivity

Select item 180795.

an image of a chemical structure CID 18079

Diberal; Dmbeb; 2964-06-9 ...

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-ethyl-5-(4-methylpentan-2-yl)-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-26

CID:: 18079

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 906795776.

an image of a chemical structure CID 90679577

MW:: 268.350
MF:: C₁₄H₂₄N₂O₃

IUPAC name:: 5-butyl-5-(3,3-dimethylbutan-2-yl)-1,3-diazinane-2,4,6-trion...

Create Date:: 2015-03-11

CID:: 90679577

Summary Similar Compounds Same Parent, Connectivity

Select item 906795757.

an image of a chemical structure CID 90679575

MW:: 254.330
MF:: C₁₃H₂₂N₂O₃

IUPAC name:: 5-(3,3-dimethylbutan-2-yl)-5-propyl-1,3-diazinane-2,4,6-trio...

Create Date:: 2015-03-11

CID:: 90679575

Summary Similar Compounds Same Parent, Connectivity

Select item 671055108.

an image of a chemical structure CID 67105510

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-ethyl-5-[(3S)-hexan-3-yl]-1,3-diazinane-2,4,6-trione

Create Date:: 2012-11-30

CID:: 67105510

Summary Similar Compounds Same Parent, Connectivity

Select item 450381609.

an image of a chemical structure CID 45038160

Amobarbital-d5; 1190003-63-4; A936100 ...

MW:: 231.300
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-(3-methylbutyl)-5-(1,1,2,2,2-pentadeuterioethyl)-1,3-diazi...

Create Date:: 2010-03-29

CID:: 45038160

Summary Similar Compounds Same Parent, Connectivity

Select item 2160013210.

an image of a chemical structure CID 21600132

PENTOBARBITAL-D5; 52944-66-8; XKC28WZ299 ...

MW:: 231.300
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-(1,1,2,2,2-pentadeuterioethyl)-5-pentan-2-yl-1,3-diazinane...

Create Date:: 2007-12-05

CID:: 21600132

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 45121611.

an image of a chemical structure CID 451216

MW:: 225.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-(111C)ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-27

CID:: 451216

Summary Similar Compounds Same Parent, Connectivity

Select item 45121112.

an image of a chemical structure CID 451211

MW:: 225.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-(111C)ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-27

CID:: 451211

Summary Similar Compounds Same Parent, Connectivity

Select item 10153413.

an image of a chemical structure CID 101534

Tetrabarbital; 76-23-3; 5-ethyl-5-hexan-3-yl-1,3-diazinane-2,4,6-trione ...

MW:: 240.300
MF:: C₁₂H₂₀N₂O₃

IUPAC name:: 5-ethyl-5-hexan-3-yl-1,3-diazinane-2,4,6-trione

Create Date:: 2005-08-08

CID:: 101534

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 8898314.

an image of a chemical structure CID 88983

(R)-pentobarbital; (+)-Pentobarbital; 8DF73ON6SJ ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-ethyl-5-[(2R)-pentan-2-yl]-1,3-diazinane-2,4,6-trione

Create Date:: 2005-07-10

CID:: 88983

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 8898115.

an image of a chemical structure CID 88981

(-)-Pentobarbitone; Pentobarbital, (S)-; UNII-U7D0E1VOAM ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-ethyl-5-[(2S)-pentan-2-yl]-1,3-diazinane-2,4,6-trione

Create Date:: 2005-07-10

CID:: 88981

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 4816016.

an image of a chemical structure CID 48160

66843-05-8; 5-Methyl-5-(1-methylpentyl)barbituric acid; BRN 0210120 ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-hexan-2-yl-5-methyl-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-26

CID:: 48160

Summary Similar Compounds Same Parent, Connectivity

Select item 473717.

an image of a chemical structure CID 4737

pentobarbital; Pentobarbitone; Nembutal ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-ethyl-5-pentan-2-yl-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-25

CID:: 4737

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 216418.

an image of a chemical structure CID 2164

amobarbital; Amylobarbitone; Isomytal ...

MW:: 226.270
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-ethyl-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione

Create Date:: 2005-03-25

CID:: 2164

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 16336044719.

an image of a chemical structure CID 163360447

MW:: 231.300
MF:: C₁₁H₁₈N₂O₃

IUPAC name:: 5-(2-methylpropyl)-5-(1,1,2,3,3-pentadeuteriopropyl)-1,3-dia...

Create Date:: 2022-06-22

CID:: 163360447

Summary Similar Compounds Same Parent, Connectivity

Select item 15879014820.

an image of a chemical structure CID 158790148

MW:: 265.370
MF:: C₁₁H₁₈KN₂O₃

Create Date:: 2021-12-03

CID:: 158790148

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

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Chemical Properties

Rule of 5 (125)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

BioActivity Experiments

BioAssays, Active (5)
Compounds identified as active in screening experiments

BioAssays, Tested (53)
Compounds identified as tested in screening experiments

Protein 3D Structures (1)
Compounds bound to proteins in atructure biology experiments

BioMedical Annotation

Pharmacological Actions (8)
Therapeutic use and National Library of Medicine (NLM) compound classifications

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