1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide

C14H19ClN2O — CID 81484979

IUPAC1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide
SMILESNCC1(C(=O)NCc2ccccc2Cl)CCCC1
InChIInChI=1S/C14H19ClN2O/c15-12-6-2-1-5-11(12)9-17-13(18)14(10-16)7-3-4-8-14/h1-2,5-6H,3-4,7-10,16H2,(H,17,18)
InChIKeySBWSXZMGGFLLNM-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.48
Rot. Bonds4

About 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide

1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide (PubChem CID 81484979) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide
PubChem CID81484979
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide
SMILESNCC1(C(=O)NCc2ccccc2Cl)CCCC1
InChIInChI=1S/C14H19ClN2O/c15-12-6-2-1-5-11(12)9-17-13(18)14(10-16)7-3-4-8-14/h1-2,5-6H,3-4,7-10,16H2,(H,17,18)
InChIKeySBWSXZMGGFLLNM-UHFFFAOYSA-N
XLogP2.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-[(2-bromophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119707366
1-(aminomethyl)-N-[(2-bromophenyl)methyl]cyclobutane-1-carboxamide
CID 113311677
N-[(2-chlorophenyl)methyl]-4-ethylpiperidine-4-carboxamide
CID 63127175
1-(aminomethyl)-N-[(4-chlorophenyl)methyl]cyclobutane-1-carboxamide
CID 113311558
1-(aminomethyl)-N-[1-(2-chlorophenyl)propan-2-yl]cyclobutane-1-carboxamide
CID 115447507
1-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]cyclohexane-1-carboxylic acid
CID 43397115
4-(aminomethyl)-N-[2-(2-chlorophenyl)ethyl]oxane-4-carboxamide
CID 120921537
4-(aminomethyl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]oxane-4-carboxamide
CID 120920802
N-[(2-chlorophenyl)methyl]-1-[(E)-N'-hydroxycarbamimidoyl]cyclobutane-1-carboxamide
CID 80591093
4-(aminomethyl)-N-[(2-ethylphenyl)methyl]oxane-4-carboxamide
CID 64679884
1-[[[2-(2-chlorophenyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 81362454
N-[(2-chlorophenyl)methyl]-3-methylpyrrolidine-3-carboxamide
CID 63140593

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide (CID 81484979) is 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide is NCC1(C(=O)NCc2ccccc2Cl)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is SBWSXZMGGFLLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c15-12-6-2-1-5-11(12)9-17-13(18)14(10-16)7-3-4-8-14/h1-2,5-6H,3-4,7-10,16H2,(H,17,18).
What are the key properties of 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide?
1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 266.77 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[(2-chlorophenyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 81484979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).