2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide

C15H22N2O — CID 64823369

IUPAC2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCCCc1ccccc1
InChIInChI=1S/C15H22N2O/c16-14-10-4-9-13(14)15(18)17-11-5-8-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,16H2,(H,17,18)
InChIKeyXMYPZNVPWRTVLE-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.86
Rot. Bonds5

About 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide

2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide (PubChem CID 64823369) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide
PubChem CID64823369
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCCCc1ccccc1
InChIInChI=1S/C15H22N2O/c16-14-10-4-9-13(14)15(18)17-11-5-8-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,16H2,(H,17,18)
InChIKeyXMYPZNVPWRTVLE-UHFFFAOYSA-N
XLogP1.86
TPSA55.12 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 ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

trans-(1S,2S)-2-(3-phenylpropylcarbamoyl)cyclohexane-1-carboxylate
CID 2165135
cis-(1R,2S)-2-(4-phenylbutylcarbamoyl)cyclohexane-1-carboxylic acid
CID 7034638
cis-(1R,2S)-2-methyl-N-(3-phenylpropyl)cyclopropane-1-carboxamide
CID 94014482
(1R)-2-(2-oxo-2-phenylacetyl)-N-(4-phenylbutyl)cyclohexane-1-carboxamide
CID 58648558
cis-(1R,2S)-2-hydroxy-N-(2-phenylethyl)cyclohexane-1-carboxamide
CID 13313986
2-amino-N-[2-(4-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 64817742
2-amino-N-(4-hydroxybutyl)cyclopentane-1-carboxamide
CID 106842187
cis-(1R,2S)-2-amino-N-(2-phenoxyethyl)cyclohexane-1-carboxamide
CID 69204145
2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
CID 64822976
trans-(1R,2R)-2-(2-phenylethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 795950
N-[3-(4-chlorophenyl)propyl]-2-hydroxycyclopentane-1-carboxamide
CID 110014408
2-amino-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide
CID 64816964

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide (CID 64823369) is 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide is NC1CCCC1C(=O)NCCCc1ccccc1.
What is the InChIKey of 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide?
The InChIKey is XMYPZNVPWRTVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c16-14-10-4-9-13(14)15(18)17-11-5-8-12-6-2-1-3-7-12/h1-3,6-7,13-14H,4-5,8-11,16H2,(H,17,18).
What are the key properties of 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide?
2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64823369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).