3-(cyclopentylamino)-N-phenylbutanamide

C15H22N2O — CID 113218911

IUPAC3-(cyclopentylamino)-N-phenylbutanamide
SMILESCC(CC(=O)Nc1ccccc1)NC1CCCC1
InChIInChI=1S/C15H22N2O/c1-12(16-13-9-5-6-10-13)11-15(18)17-14-7-3-2-4-8-14/h2-4,7-8,12-13,16H,5-6,9-11H2,1H3,(H,17,18)
InChIKeyFUNGXAIUFLLTIU-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.94
Rot. Bonds5

About 3-(cyclopentylamino)-N-phenylbutanamide

3-(cyclopentylamino)-N-phenylbutanamide (PubChem CID 113218911) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-(cyclopentylamino)-N-phenylbutanamide.

Molecular Properties

Compound Name3-(cyclopentylamino)-N-phenylbutanamide
PubChem CID113218911
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-(cyclopentylamino)-N-phenylbutanamide
SMILESCC(CC(=O)Nc1ccccc1)NC1CCCC1
InChIInChI=1S/C15H22N2O/c1-12(16-13-9-5-6-10-13)11-15(18)17-14-7-3-2-4-8-14/h2-4,7-8,12-13,16H,5-6,9-11H2,1H3,(H,17,18)
InChIKeyFUNGXAIUFLLTIU-UHFFFAOYSA-N
XLogP2.94
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[4-(4-bromoanilino)-4-oxobutan-2-yl]amino]cyclohexane-1-carboxylic acid
CID 122039125
(3R)-3-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-phenylbutanamide
CID 97018627
3-(2,2-difluoroethylamino)-N-phenylbutanamide
CID 114244264
2-[(4-anilino-4-oxobutan-2-yl)amino]propanoic acid
CID 114244259
(3R)-3-chloro-N-phenylbutanamide
CID 94188827
(3S)-3,4-dimethyl-N-phenylpentanamide
CID 102017324
2-[(2-anilino-2-oxoethyl)-methylamino]-N-cyclohexylpropanamide
CID 86979720
N-[4-[[2-(cyclohexylamino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54816270
2-[(2-anilino-2-oxoethyl)amino]-N-cyclopropylpropanamide
CID 112696312
(3S)-3-[[(3S)-1,1-dioxothiolan-3-yl]amino]-N-(4-methylphenyl)butanamide
CID 9453372
(3S)-N-(4-fluorophenyl)-3-[[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]amino]butanamide
CID 124515076
4-anilino-2-cyclopropyl-4-oxobutanoic acid
CID 165476532

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylamino)-N-phenylbutanamide?
The IUPAC name of 3-(cyclopentylamino)-N-phenylbutanamide (CID 113218911) is 3-(cyclopentylamino)-N-phenylbutanamide.
What is the SMILES notation for 3-(cyclopentylamino)-N-phenylbutanamide?
The canonical SMILES for 3-(cyclopentylamino)-N-phenylbutanamide is CC(CC(=O)Nc1ccccc1)NC1CCCC1.
What is the InChIKey of 3-(cyclopentylamino)-N-phenylbutanamide?
The InChIKey is FUNGXAIUFLLTIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12(16-13-9-5-6-10-13)11-15(18)17-14-7-3-2-4-8-14/h2-4,7-8,12-13,16H,5-6,9-11H2,1H3,(H,17,18).
What are the key properties of 3-(cyclopentylamino)-N-phenylbutanamide?
3-(cyclopentylamino)-N-phenylbutanamide has a molecular weight of 246.35 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylamino)-N-phenylbutanamide is sourced from PubChem (CID 113218911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).