N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide

C14H17N3O2 — CID 103856996

IUPACN-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide
SMILESO=C(NC1CCCC1CO)c1ccc2nc[nH]c2c1
InChIInChI=1S/C14H17N3O2/c18-7-10-2-1-3-11(10)17-14(19)9-4-5-12-13(6-9)16-8-15-12/h4-6,8,10-11,18H,1-3,7H2,(H,15,16)(H,17,19)
InChIKeyWZJMJRRKZMZLAW-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.45
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide

N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide (PubChem CID 103856996) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide
PubChem CID103856996
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide
SMILESO=C(NC1CCCC1CO)c1ccc2nc[nH]c2c1
InChIInChI=1S/C14H17N3O2/c18-7-10-2-1-3-11(10)17-14(19)9-4-5-12-13(6-9)16-8-15-12/h4-6,8,10-11,18H,1-3,7H2,(H,15,16)(H,17,19)
InChIKeyWZJMJRRKZMZLAW-UHFFFAOYSA-N
XLogP1.45
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cycloheptyl-3H-benzimidazole-5-carboxamide
CID 27646859
N-[(2-methylcyclopentyl)methyl]-3H-benzimidazole-5-carboxamide
CID 107420236
N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-benzimidazole-5-carboxamide
CID 111697069
N-[2-(hydroxymethyl)cyclopentyl]-1,3-benzothiazole-6-carboxamide
CID 103774075
N-[(1R,2R)-2-(3,4-dimethoxyphenyl)cyclohexyl]-3H-benzimidazole-5-carboxamide
CID 70099471
N-[2-(hydroxymethyl)cyclopentyl]-3,4-dimethoxybenzamide
CID 103751338
N-[1-(2-hydroxyethyl)piperidin-4-yl]-3H-benzimidazole-5-carboxamide
CID 162475306
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
N-(1,3-dimethylpiperidin-4-yl)-3H-benzimidazole-5-carboxamide
CID 18723319
N-(3-aminocyclobutyl)-3H-benzimidazole-5-carboxamide
CID 43594956
N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide
CID 114549479
2-chloro-N-[2-(hydroxymethyl)cyclohexyl]quinoline-6-carboxamide
CID 110011733

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide (CID 103856996) is N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide is O=C(NC1CCCC1CO)c1ccc2nc[nH]c2c1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide?
The InChIKey is WZJMJRRKZMZLAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c18-7-10-2-1-3-11(10)17-14(19)9-4-5-12-13(6-9)16-8-15-12/h4-6,8,10-11,18H,1-3,7H2,(H,15,16)(H,17,19).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide?
N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.45, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 103856996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).