2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide

C23H27N3O — CID 77086079

IUPAC2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide
SMILESCc1cccc2[nH]c(CCNC(=O)C(c3ccccc3)C3CCCC3)nc12
InChIInChI=1S/C23H27N3O/c1-16-8-7-13-19-22(16)26-20(25-19)14-15-24-23(27)21(18-11-5-6-12-18)17-9-3-2-4-10-17/h2-4,7-10,13,18,21H,5-6,11-12,14-15H2,1H3,(H,24,27)(H,25,26)
InChIKeyLXLUBYHPCQSNKA-UHFFFAOYSA-N
MW361.49 g/mol
LogP4.50
Rot. Bonds6

About 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide

2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide (PubChem CID 77086079) has the molecular formula C23H27N3O and a molecular weight of 361.49 g/mol. Its IUPAC name is 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide
PubChem CID77086079
Molecular FormulaC23H27N3O
Molecular Weight361.49 g/mol
Exact Mass361.22
IUPAC Name2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide
SMILESCc1cccc2[nH]c(CCNC(=O)C(c3ccccc3)C3CCCC3)nc12
InChIInChI=1S/C23H27N3O/c1-16-8-7-13-19-22(16)26-20(25-19)14-15-24-23(27)21(18-11-5-6-12-18)17-9-3-2-4-10-17/h2-4,7-10,13,18,21H,5-6,11-12,14-15H2,1H3,(H,24,27)(H,25,26)
InChIKeyLXLUBYHPCQSNKA-UHFFFAOYSA-N
XLogP4.50
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-hydroxypiperidin-1-yl)-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]acetamide
CID 118796145
(1S,5R)-3-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 56912067
N-(2-amino-1-cyclohexylethyl)-3-(4-methyl-1H-benzimidazol-2-yl)propanamide;dihydrochloride
CID 119590593
N-methyl-2-(4-methyl-1H-benzimidazol-2-yl)ethanamine
CID 26722492
1-[3-(4-methyl-1H-benzimidazol-2-yl)propanoyl]pyrrolidine-2-carboxylic acid
CID 119356105
N-(3-aminobutyl)-3-(4-methyl-1H-benzimidazol-2-yl)propanamide
CID 119497235
(2S)-2-(2-hydroxyethyl)-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-3-oxopiperazine-1-carboxamide
CID 126439930
(2R)-N-(cyanomethyl)-2-cyclohexyl-2-phenylacetamide
CID 125465712
3-(4-methyl-1H-benzimidazol-2-yl)-1-(2-methylpyrrolidin-1-yl)propan-1-one
CID 166227033
2-cyclopropyl-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-phenylacetamide
CID 110415384
N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]propane-2-sulfonamide
CID 131929792
(4S)-4-(furan-3-yl)-6-methyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 95205110

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide?
The IUPAC name of 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide (CID 77086079) is 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide.
What is the SMILES notation for 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide?
The canonical SMILES for 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide is Cc1cccc2[nH]c(CCNC(=O)C(c3ccccc3)C3CCCC3)nc12.
What is the InChIKey of 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide?
The InChIKey is LXLUBYHPCQSNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O/c1-16-8-7-13-19-22(16)26-20(25-19)14-15-24-23(27)21(18-11-5-6-12-18)17-9-3-2-4-10-17/h2-4,7-10,13,18,21H,5-6,11-12,14-15H2,1H3,(H,24,27)(H,25,26).
What are the key properties of 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide?
2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide has a molecular weight of 361.49 g/mol, XLogP of 4.50, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[2-(4-methyl-1H-benzimidazol-2-yl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 77086079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).