4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide

C21H24N4O2 — CID 73051604

IUPAC4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide
SMILESCNC(=O)c1ccc(Nc2nc3ccccc3n2C2CCCC2)c(OC)c1
InChIInChI=1S/C21H24N4O2/c1-22-20(26)14-11-12-17(19(13-14)27-2)24-21-23-16-9-5-6-10-18(16)25(21)15-7-3-4-8-15/h5-6,9-13,15H,3-4,7-8H2,1-2H3,(H,22,26)(H,23,24)
InChIKeyJLRGZAXVOCHKAV-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.26
Rot. Bonds5

About 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide

4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide (PubChem CID 73051604) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide
PubChem CID73051604
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC Name4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide
SMILESCNC(=O)c1ccc(Nc2nc3ccccc3n2C2CCCC2)c(OC)c1
InChIInChI=1S/C21H24N4O2/c1-22-20(26)14-11-12-17(19(13-14)27-2)24-21-23-16-9-5-6-10-18(16)25(21)15-7-3-4-8-15/h5-6,9-13,15H,3-4,7-8H2,1-2H3,(H,22,26)(H,23,24)
InChIKeyJLRGZAXVOCHKAV-UHFFFAOYSA-N
XLogP4.26
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-cyclopentylbenzimidazol-2-yl)-2-methylpyridine-4-carboxamide
CID 136538090
4-(aminomethyl)-N-(1-cyclopentylbenzimidazol-2-yl)benzamide;hydrochloride
CID 119332720
N-[1-[4-[(1-cyclohexylbenzimidazol-2-yl)amino]phenyl]ethenyl]hydroxylamine
CID 149197235
methyl 4-[[1-[(1S)-3,3-dimethylcyclohexyl]benzimidazol-2-yl]amino]benzoate
CID 137447038
N-(1-cyclohexylbenzimidazol-2-yl)-3-(propan-2-ylsulfamoyl)benzamide
CID 52655657
1-cyclopropyl-N-methylbenzimidazol-2-amine
CID 21043921
4-[(1-cyclobutylbenzimidazol-2-yl)amino]-N-hydroxybenzamide;4-[(1-cyclopentylbenzimidazol-2-yl)amino]-N-hydroxybenzamide;N-hydroxy-4-[[1-(2-methoxyethyl)benzimidazol-2-yl]amino]benzamide;N-hydroxy-4-[(1-methylbenzimidazol-2-yl)amino]benzamide;N-hydroxy-4-[(1-propan-2-ylbenzimidazol-2-yl)amino]benzamide
CID 158166731
N-(1-cyclohexylbenzimidazol-2-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119732157
N-[4-[(1-cyclopentylbenzimidazol-2-yl)amino]phenyl]-2-(dimethylamino)acetamide
CID 73051603
4-[[(8R)-9-cyclopentyl-5,8-dimethyl-6-methylidene-7,8-dihydropyrimido[4,5-b][1,4]diazepin-2-yl]amino]-3-methoxy-N-methylbenzamide
CID 89113170
4-cyclopentyl-N-[2-methoxy-5-(methylcarbamoyl)phenyl]piperazine-1-carboxamide
CID 86995011
3-amino-N-(1-cyclopentylbenzimidazol-2-yl)-3-phenylpropanamide;hydrochloride
CID 119951926

Frequently Asked Questions

What is the IUPAC name of 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide?
The IUPAC name of 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide (CID 73051604) is 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide.
What is the SMILES notation for 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide?
The canonical SMILES for 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide is CNC(=O)c1ccc(Nc2nc3ccccc3n2C2CCCC2)c(OC)c1.
What is the InChIKey of 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide?
The InChIKey is JLRGZAXVOCHKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-22-20(26)14-11-12-17(19(13-14)27-2)24-21-23-16-9-5-6-10-18(16)25(21)15-7-3-4-8-15/h5-6,9-13,15H,3-4,7-8H2,1-2H3,(H,22,26)(H,23,24).
What are the key properties of 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide?
4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide has a molecular weight of 364.45 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-cyclopentylbenzimidazol-2-yl)amino]-3-methoxy-N-methylbenzamide is sourced from PubChem (CID 73051604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).