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

C16H24N2O — CID 60866681

IUPAC1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
SMILESCCc1ccc(C(C)NC(=O)C2(N)CCCC2)cc1
InChIInChI=1S/C16H24N2O/c1-3-13-6-8-14(9-7-13)12(2)18-15(19)16(17)10-4-5-11-16/h6-9,12H,3-5,10-11,17H2,1-2H3,(H,18,19)
InChIKeyXSTCFGVLFRYCTA-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.70
Rot. Bonds4

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

1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 60866681) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID60866681
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
SMILESCCc1ccc(C(C)NC(=O)C2(N)CCCC2)cc1
InChIInChI=1S/C16H24N2O/c1-3-13-6-8-14(9-7-13)12(2)18-15(19)16(17)10-4-5-11-16/h6-9,12H,3-5,10-11,17H2,1-2H3,(H,18,19)
InChIKeyXSTCFGVLFRYCTA-UHFFFAOYSA-N
XLogP2.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[(1S)-1-(4-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81350015
1-amino-N-[(1S)-1-phenylethyl]cyclobutane-1-carboxamide
CID 81169221
1-amino-N-[1-[4-(trifluoromethyl)phenyl]ethyl]cyclohexane-1-carboxamide
CID 119280379
1-amino-N-[1-(4-methylsulfonylphenyl)ethyl]cyclobutane-1-carboxamide
CID 81172890
1-amino-N-[(1S)-1-(4-bromophenyl)ethyl]cyclopropane-1-carboxamide
CID 81359922
1-amino-N-[1-[4-(methylsulfamoyl)phenyl]ethyl]cyclohexane-1-carboxamide
CID 119304099
1-amino-N-[1-[4-(2,2,2-trifluoroethoxy)phenyl]ethyl]cyclohexane-1-carboxamide
CID 119303272
1-amino-N-(1-phenylethyl)cyclopropane-1-carboxamide
CID 65465678
1-amino-N-[1-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119706519
1-amino-N-[1-[4-(dimethylsulfamoyl)phenyl]ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119299101
1-amino-N-[1-(4-propan-2-yloxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119716690
1-amino-N-(4-ethylphenyl)cyclopentane-1-carboxamide
CID 60867224

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide (CID 60866681) is 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide is CCc1ccc(C(C)NC(=O)C2(N)CCCC2)cc1.
What is the InChIKey of 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is XSTCFGVLFRYCTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-13-6-8-14(9-7-13)12(2)18-15(19)16(17)10-4-5-11-16/h6-9,12H,3-5,10-11,17H2,1-2H3,(H,18,19).
What are the key properties of 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide?
1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 60866681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).