1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide

C16H24N2O — CID 61251912

IUPAC1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)C1(N)CCCC1
InChIInChI=1S/C16H24N2O/c1-13(9-10-14-7-3-2-4-8-14)18-15(19)16(17)11-5-6-12-16/h2-4,7-8,13H,5-6,9-12,17H2,1H3,(H,18,19)
InChIKeyHMFAEZCMURKAJQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.40
Rot. Bonds5

About 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide

1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide (PubChem CID 61251912) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
PubChem CID61251912
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)C1(N)CCCC1
InChIInChI=1S/C16H24N2O/c1-13(9-10-14-7-3-2-4-8-14)18-15(19)16(17)11-5-6-12-16/h2-4,7-8,13H,5-6,9-12,17H2,1H3,(H,18,19)
InChIKeyHMFAEZCMURKAJQ-UHFFFAOYSA-N
XLogP2.40
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[4-(4-methoxyphenyl)butan-2-yl]cyclopentane-1-carboxamide
CID 119288107
1-phenyl-N-[(2S)-4-phenylbutan-2-yl]cyclopentane-1-carboxamide
CID 1220424
2-amino-1-methyl-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 82767340
1-amino-N-[(1S)-1-phenylethyl]cyclobutane-1-carboxamide
CID 81169221
(2R)-2-[(1-aminocyclopentanecarbonyl)amino]-3-phenylpropanoic acid
CID 103869046
1-amino-N-[1-(3-bromophenyl)propan-2-yl]cyclohexane-1-carboxamide
CID 119298802
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
CID 14620809
N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 6933208
1-amino-N-[1-(4-phenylpiperazin-1-yl)propan-2-yl]cyclopentane-1-carboxamide
CID 119903462
1-amino-N-[3-[benzyl(methyl)amino]butyl]cyclohexane-1-carboxamide
CID 119899255
1-amino-N-methyl-N-(2-phenylethyl)cyclohexane-1-carboxamide
CID 54871932
1-amino-N-(5-methylhexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119263591

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide (CID 61251912) is 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide is CC(CCc1ccccc1)NC(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide?
The InChIKey is HMFAEZCMURKAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13(9-10-14-7-3-2-4-8-14)18-15(19)16(17)11-5-6-12-16/h2-4,7-8,13H,5-6,9-12,17H2,1H3,(H,18,19).
What are the key properties of 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide?
1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 61251912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).