1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide

C14H19ClN2O — CID 60938892

IUPAC1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCCC1
InChIInChI=1S/C14H19ClN2O/c1-17(10-11-4-6-12(15)7-5-11)13(18)14(16)8-2-3-9-14/h4-7H,2-3,8-10,16H2,1H3
InChIKeyNWHOQHOJXAJJEN-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.57
Rot. Bonds3

About 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide

1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide (PubChem CID 60938892) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide
PubChem CID60938892
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCCC1
InChIInChI=1S/C14H19ClN2O/c1-17(10-11-4-6-12(15)7-5-11)13(18)14(16)8-2-3-9-14/h4-7H,2-3,8-10,16H2,1H3
InChIKeyNWHOQHOJXAJJEN-UHFFFAOYSA-N
XLogP2.57
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[(4-fluorophenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119268138
1-amino-N-[(4-methoxyphenyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 54869116
1-amino-N-methyl-N-[(4-methylsulfanylphenyl)methyl]cyclobutane-1-carboxamide
CID 81171712
1-amino-N-[(4-methoxyphenyl)methyl]-N-methylcyclopropane-1-carboxamide
CID 65465742
N-[(4-chlorophenyl)methyl]-1-cyano-N-methylcyclopropane-1-carboxamide
CID 80597882
1-amino-N-methyl-N-[(4-propan-2-ylphenyl)methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119681945
1-(4-chlorophenyl)-N-[(4-chlorophenyl)methyl]-N-methylcyclopropane-1-carboxamide
CID 112790191
1-amino-N-[(3,4-difluorophenyl)methyl]-N-methylcyclopropane-1-carboxamide;hydrochloride
CID 119717238
1-amino-N-[(4-hydroxy-3-methoxyphenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119279477
2,2-dichloro-N-[(4-chlorophenyl)methyl]-N,1-dimethylcyclopropane-1-carboxamide
CID 78784523
N-[(4-chlorophenyl)methyl]-3-ethyl-N-methylpyrrolidine-3-carboxamide
CID 63140326
1-amino-N-[(3-bromophenyl)methyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119285924

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide (CID 60938892) is 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide is CN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCCC1.
What is the InChIKey of 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide?
The InChIKey is NWHOQHOJXAJJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-17(10-11-4-6-12(15)7-5-11)13(18)14(16)8-2-3-9-14/h4-7H,2-3,8-10,16H2,1H3.
What are the key properties of 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide?
1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide has a molecular weight of 266.77 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(4-chlorophenyl)methyl]-N-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 60938892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).