N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide

C16H21N3O — CID 110779431

IUPACN-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide
SMILESCCCC(=O)Nc1ccc2nc(C3CCCC3)[nH]c2c1
InChIInChI=1S/C16H21N3O/c1-2-5-15(20)17-12-8-9-13-14(10-12)19-16(18-13)11-6-3-4-7-11/h8-11H,2-7H2,1H3,(H,17,20)(H,18,19)
InChIKeyINOPUBHPKNKMGA-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.96
Rot. Bonds4

About N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide

N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide (PubChem CID 110779431) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide.

Molecular Properties

Compound NameN-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide
PubChem CID110779431
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide
SMILESCCCC(=O)Nc1ccc2nc(C3CCCC3)[nH]c2c1
InChIInChI=1S/C16H21N3O/c1-2-5-15(20)17-12-8-9-13-14(10-12)19-16(18-13)11-6-3-4-7-11/h8-11H,2-7H2,1H3,(H,17,20)(H,18,19)
InChIKeyINOPUBHPKNKMGA-UHFFFAOYSA-N
XLogP3.96
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(2-cyclobutyl-3H-benzimidazol-5-yl)butanamide;dihydrochloride
CID 119872008
(1R,4S)-4-[(2-cyclohexyl-3H-benzimidazol-5-yl)carbamoyl]cyclobut-2-ene-1-carboxylic acid
CID 167922413
N-(2-cyclopentyl-3H-benzimidazol-5-yl)pyridine-2-carboxamide
CID 110793292
1-(2-cyclopentyl-3H-benzimidazol-5-yl)ethanone
CID 82494798
1-(2-cyclopentyl-3H-benzimidazol-5-yl)propan-1-one
CID 82497253
N-(2-cyclopentyl-3H-benzimidazol-5-yl)pyridine-3-carboxamide;hydrochloride
CID 110779436
N-(2-cyclobutyl-3H-benzimidazol-5-yl)furan-3-carboxamide
CID 52827537
N-(2-cyclobutyl-3H-benzimidazol-5-yl)piperidine-3-carboxamide
CID 119871952
N-(2-cyclohexyl-3H-benzimidazol-5-yl)-3-methoxybenzamide;N-methylmethanamine
CID 118096520
N-[2-(2,6-dichlorophenyl)-3H-benzimidazol-5-yl]butanamide
CID 25066170
1-[4-(6-methyl-1H-benzimidazol-2-yl)piperidin-1-yl]butan-1-one
CID 108733576
2-cyclopentyl-3H-benzimidazole-5-carboxylic acid
CID 43168815

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide?
The IUPAC name of N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide (CID 110779431) is N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide.
What is the SMILES notation for N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide?
The canonical SMILES for N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide is CCCC(=O)Nc1ccc2nc(C3CCCC3)[nH]c2c1.
What is the InChIKey of N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide?
The InChIKey is INOPUBHPKNKMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-5-15(20)17-12-8-9-13-14(10-12)19-16(18-13)11-6-3-4-7-11/h8-11H,2-7H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide?
N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide has a molecular weight of 271.36 g/mol, XLogP of 3.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentyl-3H-benzimidazol-5-yl)butanamide is sourced from PubChem (CID 110779431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).