3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide

C16H24N2O — CID 119760925

IUPAC3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
SMILESCCc1ccc(CCNC(=O)C2CCC(N)C2)cc1
InChIInChI=1S/C16H24N2O/c1-2-12-3-5-13(6-4-12)9-10-18-16(19)14-7-8-15(17)11-14/h3-6,14-15H,2,7-11,17H2,1H3,(H,18,19)
InChIKeyZJIZGAMECIPXCV-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.04
Rot. Bonds5

About 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 119760925) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID119760925
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
SMILESCCc1ccc(CCNC(=O)C2CCC(N)C2)cc1
InChIInChI=1S/C16H24N2O/c1-2-12-3-5-13(6-4-12)9-10-18-16(19)14-7-8-15(17)11-14/h3-6,14-15H,2,7-11,17H2,1H3,(H,18,19)
InChIKeyZJIZGAMECIPXCV-UHFFFAOYSA-N
XLogP2.04
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 ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(4-ethylphenyl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673281
methyl 4-[2-[(3-aminocyclohexanecarbonyl)amino]ethyl]benzoate;hydrochloride
CID 119701390
N-[2-(4-acetamidophenyl)ethyl]-3-aminocyclohexane-1-carboxamide
CID 119755530
3-amino-N-[2-(3-methoxy-4-methylphenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119788200
3-amino-N-[2-(4-methoxyphenyl)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119673157
3-amino-N-[2-(3-fluoro-4-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 119774826
3-[2-[(3-aminocyclopentanecarbonyl)amino]ethyl]benzamide;hydrochloride
CID 119770305
3-amino-N-[(4-methylphenyl)methyl]cyclopentane-1-carboxamide
CID 66033053
3-amino-N-[2-(4-fluoro-2-methylphenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119814173
cis-(1S,3R)-3-amino-N-[2-[3-(trifluoromethyl)phenyl]ethyl]cyclopentane-1-carboxamide
CID 56918619
3-amino-N-[2-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 66031268
3-amino-N-[2-(5-bromothiophen-2-yl)ethyl]cyclopentane-1-carboxamide
CID 113266074

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide (CID 119760925) is 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide is CCc1ccc(CCNC(=O)C2CCC(N)C2)cc1.
What is the InChIKey of 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is ZJIZGAMECIPXCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-2-12-3-5-13(6-4-12)9-10-18-16(19)14-7-8-15(17)11-14/h3-6,14-15H,2,7-11,17H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119760925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).