(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide

C24H29NO — CID 118091164

IUPAC(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc([C@@H](C(=O)Nc2cccc(CC3CC3)c2)C2CCCC2)cc1
InChIInChI=1S/C24H29NO/c1-17-9-13-21(14-10-17)23(20-6-2-3-7-20)24(26)25-22-8-4-5-19(16-22)15-18-11-12-18/h4-5,8-10,13-14,16,18,20,23H,2-3,6-7,11-12,15H2,1H3,(H,25,26)/t23-/m0/s1
InChIKeyGBSFHPVDAOCIFS-QHCPKHFHSA-N
MW347.50 g/mol
LogP5.86
Rot. Bonds6

About (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide

(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 118091164) has the molecular formula C24H29NO and a molecular weight of 347.50 g/mol. Its IUPAC name is (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide
PubChem CID118091164
Molecular FormulaC24H29NO
Molecular Weight347.50 g/mol
Exact Mass347.22
IUPAC Name(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc([C@@H](C(=O)Nc2cccc(CC3CC3)c2)C2CCCC2)cc1
InChIInChI=1S/C24H29NO/c1-17-9-13-21(14-10-17)23(20-6-2-3-7-20)24(26)25-22-8-4-5-19(16-22)15-18-11-12-18/h4-5,8-10,13-14,16,18,20,23H,2-3,6-7,11-12,15H2,1H3,(H,25,26)/t23-/m0/s1
InChIKeyGBSFHPVDAOCIFS-QHCPKHFHSA-N
XLogP5.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.50
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 118091125
carbonic acid;2-[4-[(5-chloro-2-oxo-1-pyridinyl)methyl]phenyl]-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]acetamide
CID 68752735
2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-[4-[[2-oxo-3-(trifluoromethyl)-1-pyridinyl]methyl]phenyl]acetamide
CID 68751327
carbonic acid;(2S)-2-(4-chloro-2-fluorophenyl)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]acetamide
CID 118091048
[3-[[2-(4-chlorophenyl)-2-cyclopentylacetyl]amino]phenyl]methyl cyclopropanecarboxylate
CID 174698422
2-cyclopentyl-N,2-diphenylacetamide
CID 2794045
1-[[3-[[(2S)-2-cyclopentyl-2-[4-(trifluoromethyl)phenyl]acetyl]amino]phenyl]methyl]cyclopropane-1-carboxylic acid
CID 57344330
2-cyclopentyl-N-(3,4-dimethylphenyl)-2-phenylacetamide
CID 4556080
N-[3-(cyclopropylmethyl)phenyl]-2-(4-ethylphenyl)-4,4,4-trifluoro-3-methylbutanamide
CID 67957766
2-acetamido-2-cyclopentyl-N-(3-ethylphenyl)acetamide
CID 51272125
(2S)-2-(4-benzylpiperidin-1-yl)-N-cyclopentyl-2-(4-methylphenyl)acetamide
CID 94778934
2-amino-N-[3-(tert-butylsulfonylmethyl)phenyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668464

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide (CID 118091164) is (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide is Cc1ccc([C@@H](C(=O)Nc2cccc(CC3CC3)c2)C2CCCC2)cc1.
What is the InChIKey of (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is GBSFHPVDAOCIFS-QHCPKHFHSA-N. The full InChI is InChI=1S/C24H29NO/c1-17-9-13-21(14-10-17)23(20-6-2-3-7-20)24(26)25-22-8-4-5-19(16-22)15-18-11-12-18/h4-5,8-10,13-14,16,18,20,23H,2-3,6-7,11-12,15H2,1H3,(H,25,26)/t23-/m0/s1.
What are the key properties of (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide?
(2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 347.50 g/mol, XLogP of 5.86, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclopentyl-N-[3-(cyclopropylmethyl)phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 118091164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).