2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide

C24H31NO — CID 167887997

IUPAC2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide
SMILESCC(C)CC(Cc1ccccc1)C(=O)N(c1ccccc1)C1CCCC1
InChIInChI=1S/C24H31NO/c1-19(2)17-21(18-20-11-5-3-6-12-20)24(26)25(23-15-9-10-16-23)22-13-7-4-8-14-22/h3-8,11-14,19,21,23H,9-10,15-18H2,1-2H3
InChIKeyIVLGQXUGABKDIY-UHFFFAOYSA-N
MW349.52 g/mol
LogP5.87
Rot. Bonds7

About 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide

2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide (PubChem CID 167887997) has the molecular formula C24H31NO and a molecular weight of 349.52 g/mol. Its IUPAC name is 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide.

Molecular Properties

Compound Name2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide
PubChem CID167887997
Molecular FormulaC24H31NO
Molecular Weight349.52 g/mol
Exact Mass349.24
IUPAC Name2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide
SMILESCC(C)CC(Cc1ccccc1)C(=O)N(c1ccccc1)C1CCCC1
InChIInChI=1S/C24H31NO/c1-19(2)17-21(18-20-11-5-3-6-12-20)24(26)25(23-15-9-10-16-23)22-13-7-4-8-14-22/h3-8,11-14,19,21,23H,9-10,15-18H2,1-2H3
InChIKeyIVLGQXUGABKDIY-UHFFFAOYSA-N
XLogP5.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.52
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-chloro-N-cyclohexyl-N-phenylpropanamide
CID 97357253
2-benzyl-4-methylpentanoic acid
CID 15416243
2,6-dibenzyl-N',N'-dicyclopentyl-4-hydroxyheptanediamide
CID 57320536
N-phenyl-N-[1-[(2S)-1-phenylpropan-2-yl]piperidin-4-yl]propanamide
CID 36689715
N,2-diphenyl-N-(4-propan-2-ylcyclohexyl)acetamide
CID 21025612
2-fluoro-N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 11631733
2-chloro-N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
CID 139032969
N-cyclohexyl-N-phenylcarbamoyl chloride
CID 18329458
N-cyclohexyl-N-ethyl-3-phenyl-2-sulfanylpropanamide
CID 107020965
2-amino-N-cyclohexyl-N-ethyl-3-phenylpropanamide;hydrochloride
CID 56831881
(2R)-2-amino-N-benzyl-N-cyclohexylpropanamide;hydrochloride
CID 119042549
[2-(N-cyclohexylanilino)-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium
CID 9050143

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide?
The IUPAC name of 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide (CID 167887997) is 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide.
What is the SMILES notation for 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide?
The canonical SMILES for 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide is CC(C)CC(Cc1ccccc1)C(=O)N(c1ccccc1)C1CCCC1.
What is the InChIKey of 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide?
The InChIKey is IVLGQXUGABKDIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31NO/c1-19(2)17-21(18-20-11-5-3-6-12-20)24(26)25(23-15-9-10-16-23)22-13-7-4-8-14-22/h3-8,11-14,19,21,23H,9-10,15-18H2,1-2H3.
What are the key properties of 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide?
2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide has a molecular weight of 349.52 g/mol, XLogP of 5.87, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-cyclopentyl-4-methyl-N-phenylpentanamide is sourced from PubChem (CID 167887997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).