1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride

C16H25ClN2O — CID 119330383

IUPAC1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(C(C)CNC(=O)C2(N)CCCC2)cc1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-12-5-7-14(8-6-12)13(2)11-18-15(19)16(17)9-3-4-10-16;/h5-8,13H,3-4,9-11,17H2,1-2H3,(H,18,19);1H
InChIKeyYWLOTXQHZWGNKJ-UHFFFAOYSA-N
MW296.84 g/mol
LogP2.91
Rot. Bonds4

About 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride

1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119330383) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119330383
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(C(C)CNC(=O)C2(N)CCCC2)cc1.Cl
InChIInChI=1S/C16H24N2O.ClH/c1-12-5-7-14(8-6-12)13(2)11-18-15(19)16(17)9-3-4-10-16;/h5-8,13H,3-4,9-11,17H2,1-2H3,(H,18,19);1H
InChIKeyYWLOTXQHZWGNKJ-UHFFFAOYSA-N
XLogP2.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[2-(4-methylphenyl)propyl]cyclopropane-1-carboxamide;hydrochloride
CID 119795744
1-amino-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119859906
1-amino-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119293242
1-amino-N-[(2S)-2-hydroxypropyl]cyclopentane-1-carboxamide
CID 93315414
2-amino-2-(4-methylphenyl)-N-[2-(4-methylphenyl)propyl]acetamide
CID 120668682
1-amino-N-(2-methoxy-2-phenylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119278900
1-amino-N-[2-(4-fluorophenyl)-2-methoxyethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119343019
1-amino-N-[2-(4-chlorophenyl)-2-methoxyethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119334765
1-amino-N-[2-(4-chlorophenoxy)propyl]cyclohexane-1-carboxamide;hydrochloride
CID 119335598
1-amino-N-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 119850679
3-[(1-aminocyclopentanecarbonyl)amino]-2-methylpropanoic acid
CID 62675201
1-amino-N-(4-propan-2-ylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119262760

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride (CID 119330383) is 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride is Cc1ccc(C(C)CNC(=O)C2(N)CCCC2)cc1.Cl.
What is the InChIKey of 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is YWLOTXQHZWGNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O.ClH/c1-12-5-7-14(8-6-12)13(2)11-18-15(19)16(17)9-3-4-10-16;/h5-8,13H,3-4,9-11,17H2,1-2H3,(H,18,19);1H.
What are the key properties of 1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-[2-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 296.84 g/mol, XLogP of 2.91, 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-(4-methylphenyl)propyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119330383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).