1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide

C23H25N3O2 — CID 3232129

IUPAC1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide
SMILESO=C(NC1CCc2ccccc21)c1ccc2c(c1)[nH]c(=O)n2C1CCCCC1
InChIInChI=1S/C23H25N3O2/c27-22(24-19-12-10-15-6-4-5-9-18(15)19)16-11-13-21-20(14-16)25-23(28)26(21)17-7-2-1-3-8-17/h4-6,9,11,13-14,17,19H,1-3,7-8,10,12H2,(H,24,27)(H,25,28)
InChIKeyJTABQZDARWAMJW-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.25
Rot. Bonds3

About 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide

1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide (PubChem CID 3232129) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide
PubChem CID3232129
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide
SMILESO=C(NC1CCc2ccccc21)c1ccc2c(c1)[nH]c(=O)n2C1CCCCC1
InChIInChI=1S/C23H25N3O2/c27-22(24-19-12-10-15-6-4-5-9-18(15)19)16-11-13-21-20(14-16)25-23(28)26(21)17-7-2-1-3-8-17/h4-6,9,11,13-14,17,19H,1-3,7-8,10,12H2,(H,24,27)(H,25,28)
InChIKeyJTABQZDARWAMJW-UHFFFAOYSA-N
XLogP4.25
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,1-dicyclohexyl-2-oxo-3H-benzimidazole-5-carboxamide
CID 3232123
1-[2-(diethylamino)ethyl]-N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 7451494
cis-(1R,3S)-3-[(1-cyclopentyl-2-oxo-3H-benzimidazole-5-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 120678804
1-cyclopentyl-2-oxo-N-piperidin-3-yl-3H-benzimidazole-5-carboxamide;hydrochloride
CID 119428553
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide
CID 94159469
1-cyclopentyl-N-(3-methylpiperidin-4-yl)-2-oxo-3H-benzimidazole-5-carboxamide
CID 120555427
1-ethyl-2,3-dioxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-4H-quinoxaline-6-carboxamide
CID 2649526
1-cyclopentyl-N-[(2-fluorophenyl)methyl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 71170291
(2R)-2-[(1-cyclopentyl-2-oxo-3H-benzimidazole-5-carbonyl)amino]-3-methylbutanoic acid
CID 119368330
(2R)-2-[(1-cyclopentyl-2-oxo-3H-benzimidazole-5-carbonyl)amino]-3-phenylpropanoic acid
CID 119366962
2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 40872849
1-cyclopentyl-2-oxo-N-(2-piperazin-1-ylethyl)-3H-benzimidazole-5-carboxamide;hydrochloride
CID 119448652

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide?
The IUPAC name of 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide (CID 3232129) is 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide?
The canonical SMILES for 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide is O=C(NC1CCc2ccccc21)c1ccc2c(c1)[nH]c(=O)n2C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide?
The InChIKey is JTABQZDARWAMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c27-22(24-19-12-10-15-6-4-5-9-18(15)19)16-11-13-21-20(14-16)25-23(28)26(21)17-7-2-1-3-8-17/h4-6,9,11,13-14,17,19H,1-3,7-8,10,12H2,(H,24,27)(H,25,28).
What are the key properties of 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide?
1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2,3-dihydro-1H-inden-1-yl)-2-oxo-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 3232129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).