N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide

C14H17N3O — CID 114549479

IUPACN-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc3nc[nH]c3c2)C1
InChIInChI=1S/C14H17N3O/c1-9-2-4-11(6-9)17-14(18)10-3-5-12-13(7-10)16-8-15-12/h3,5,7-9,11H,2,4,6H2,1H3,(H,15,16)(H,17,18)
InChIKeyMJDXPYYPNKOBRK-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.48
Rot. Bonds2

About N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide

N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide (PubChem CID 114549479) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide
PubChem CID114549479
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide
SMILESCC1CCC(NC(=O)c2ccc3nc[nH]c3c2)C1
InChIInChI=1S/C14H17N3O/c1-9-2-4-11(6-9)17-14(18)10-3-5-12-13(7-10)16-8-15-12/h3,5,7-9,11H,2,4,6H2,1H3,(H,15,16)(H,17,18)
InChIKeyMJDXPYYPNKOBRK-UHFFFAOYSA-N
XLogP2.48
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dimethylcyclohexyl)-3H-benzimidazole-5-carboxamide
CID 64722974
N-(2-methylpiperidin-4-yl)-3H-benzimidazole-5-carboxamide
CID 106995338
N-cycloheptyl-3H-benzimidazole-5-carboxamide
CID 27646859
N-(3-aminocyclobutyl)-3H-benzimidazole-5-carboxamide
CID 43594956
N-[(6S)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl]-3H-benzimidazole-5-carboxamide
CID 91394335
N-(1-azabicyclo[3.2.1]octan-3-yl)-3H-benzimidazole-5-carboxamide
CID 10308194
3-chloro-N-(3-methylcyclopentyl)benzamide
CID 114549458
N-[1-(propylcarbamoyl)piperidin-4-yl]-3H-benzimidazole-5-carboxamide
CID 110821957
3-methyl-N-(3-methylcyclopentyl)benzamide
CID 114550136
N-[1-(2-hydroxyethyl)piperidin-4-yl]-3H-benzimidazole-5-carboxamide
CID 162475306
N-[3-[(4-aminocyclohexyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide;dihydrochloride
CID 119475237
N-(3-methylcyclopentyl)-1H-indazole-5-carboxamide
CID 114550169

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide (CID 114549479) is N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide is CC1CCC(NC(=O)c2ccc3nc[nH]c3c2)C1.
What is the InChIKey of N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide?
The InChIKey is MJDXPYYPNKOBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-2-4-11(6-9)17-14(18)10-3-5-12-13(7-10)16-8-15-12/h3,5,7-9,11H,2,4,6H2,1H3,(H,15,16)(H,17,18).
What are the key properties of N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide?
N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 114549479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).