2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide

C23H27N3O — CID 46290733

IUPAC2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide
SMILESCc1ccc2nc(CCc3ccc(NC(=O)CC4CCCC4)cc3)[nH]c2c1
InChIInChI=1S/C23H27N3O/c1-16-6-12-20-21(14-16)26-22(25-20)13-9-17-7-10-19(11-8-17)24-23(27)15-18-4-2-3-5-18/h6-8,10-12,14,18H,2-5,9,13,15H2,1H3,(H,24,27)(H,25,26)
InChIKeyDZERBRZWUUPASH-UHFFFAOYSA-N
MW361.49 g/mol
LogP5.18
Rot. Bonds6

About 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide

2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide (PubChem CID 46290733) has the molecular formula C23H27N3O and a molecular weight of 361.49 g/mol. Its IUPAC name is 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide
PubChem CID46290733
Molecular FormulaC23H27N3O
Molecular Weight361.49 g/mol
Exact Mass361.22
IUPAC Name2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide
SMILESCc1ccc2nc(CCc3ccc(NC(=O)CC4CCCC4)cc3)[nH]c2c1
InChIInChI=1S/C23H27N3O/c1-16-6-12-20-21(14-16)26-22(25-20)13-9-17-7-10-19(11-8-17)24-23(27)15-18-4-2-3-5-18/h6-8,10-12,14,18H,2-5,9,13,15H2,1H3,(H,24,27)(H,25,26)
InChIKeyDZERBRZWUUPASH-UHFFFAOYSA-N
XLogP5.18
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 55.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]cyclohexanecarboxamide
CID 46290730
N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]-2-phenylacetamide
CID 46290758
N-[3-[2-(1H-benzimidazol-2-yl)ethyl]phenyl]-2-cyclohexylacetamide
CID 20933774
2-cyclohexyl-N-[2-[(3-hydroxyphenyl)methyl]-3H-benzimidazol-5-yl]acetamide
CID 163397660
N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]-2-oxochromene-3-carboxamide
CID 20930875
N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]-2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 50765700
2-(cyclohexylmethyl)-6-methyl-1H-benzimidazole
CID 10082509
2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide
CID 50765677
N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine
CID 82336914
2-cyclohexyl-N-(2-phenyl-3H-benzimidazol-5-yl)acetamide
CID 163397662
4-methyl-N-[2-(2-phenylethyl)-3H-benzimidazol-5-yl]benzamide
CID 46328967
1-(3,5-dimethylphenyl)-3-[2-[2-(4-fluorophenyl)ethyl]-3H-benzimidazol-5-yl]urea
CID 155114131

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide (CID 46290733) is 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide is Cc1ccc2nc(CCc3ccc(NC(=O)CC4CCCC4)cc3)[nH]c2c1.
What is the InChIKey of 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide?
The InChIKey is DZERBRZWUUPASH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O/c1-16-6-12-20-21(14-16)26-22(25-20)13-9-17-7-10-19(11-8-17)24-23(27)15-18-4-2-3-5-18/h6-8,10-12,14,18H,2-5,9,13,15H2,1H3,(H,24,27)(H,25,26).
What are the key properties of 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide?
2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide has a molecular weight of 361.49 g/mol, XLogP of 5.18, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]acetamide is sourced from PubChem (CID 46290733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).