1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride

C15H23ClN2O — CID 119331950

IUPAC1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCc1ccccc1CNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-12-7-3-4-8-13(12)11-17-14(18)15(16)9-5-6-10-15;/h3-4,7-8H,2,5-6,9-11,16H2,1H3,(H,17,18);1H
InChIKeyUMGMMSBKGXKWRX-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.56
Rot. Bonds4

About 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride

1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119331950) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119331950
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCc1ccccc1CNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-12-7-3-4-8-13(12)11-17-14(18)15(16)9-5-6-10-15;/h3-4,7-8H,2,5-6,9-11,16H2,1H3,(H,17,18);1H
InChIKeyUMGMMSBKGXKWRX-UHFFFAOYSA-N
XLogP2.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[(2-methylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119270631
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119836114
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclobutane-1-carboxamide
CID 81171767
1-amino-N-[(2-bromophenyl)methyl]cyclohexane-1-carboxamide
CID 61402383
1-amino-N-[[2-(diethylaminomethyl)phenyl]methyl]cyclopropane-1-carboxamide;dihydrochloride
CID 119836037
1-amino-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119846749
4-(aminomethyl)-N-[(2-ethylphenyl)methyl]oxane-4-carboxamide
CID 64679884
1-amino-N-[[2-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]cyclopentane-1-carboxamide
CID 119895679
1-amino-N-[[2-(trifluoromethoxy)phenyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119275621
1-amino-N-[[2-(trifluoromethyl)phenyl]methyl]cyclobutane-1-carboxamide
CID 81169624
1-amino-N-[(2,3-dimethoxyphenyl)methyl]cyclopentane-1-carboxamide
CID 119281351
1-amino-N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119864986

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride (CID 119331950) is 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride is CCc1ccccc1CNC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is UMGMMSBKGXKWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-2-12-7-3-4-8-13(12)11-17-14(18)15(16)9-5-6-10-15;/h3-4,7-8H,2,5-6,9-11,16H2,1H3,(H,17,18);1H.
What are the key properties of 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(2-ethylphenyl)methyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119331950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).