2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide

C16H24N2O — CID 64850280

IUPAC2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide
SMILESCCCCN(C(=O)C1CCCC1N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-2-3-12-18(13-8-5-4-6-9-13)16(19)14-10-7-11-15(14)17/h4-6,8-9,14-15H,2-3,7,10-12,17H2,1H3
InChIKeyBBZZOYCPPVCZAN-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.95
Rot. Bonds5

About 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide

2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide (PubChem CID 64850280) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide
PubChem CID64850280
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide
SMILESCCCCN(C(=O)C1CCCC1N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-2-3-12-18(13-8-5-4-6-9-13)16(19)14-10-7-11-15(14)17/h4-6,8-9,14-15H,2-3,7,10-12,17H2,1H3
InChIKeyBBZZOYCPPVCZAN-UHFFFAOYSA-N
XLogP2.95
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 64587130
(2S)-N-butyl-N-phenylpiperidine-2-carboxamide
CID 104914056
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CID 102945334
1-N-butyl-1-N-phenylcyclopentane-1,2-diamine
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2-[ethyl(phenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 113360944
cis-(1R,2S)-2-[2-(N-[(1S,2S)-2-carboxycyclohexanecarbonyl]anilino)ethyl-phenylcarbamoyl]cyclohexane-1-carboxylic acid
CID 51863308
N-butyl-N-phenylpyrrolidine-3-carboxamide;hydrochloride
CID 119679273
2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
CID 64824766
2-amino-N-(4-methylphenyl)-N-phenylcyclohexane-1-carboxamide
CID 70620983
N-ethyl-2-(hydroxymethyl)-N-phenylcyclohexane-1-carboxamide
CID 82121758
N-butyl-1-methyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 70296770
N-[(2-aminocyclohexyl)methyl]-N-butylaniline
CID 64584073

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide (CID 64850280) is 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide is CCCCN(C(=O)C1CCCC1N)c1ccccc1.
What is the InChIKey of 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide?
The InChIKey is BBZZOYCPPVCZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-3-12-18(13-8-5-4-6-9-13)16(19)14-10-7-11-15(14)17/h4-6,8-9,14-15H,2-3,7,10-12,17H2,1H3.
What are the key properties of 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide?
2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butyl-N-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 64850280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).