2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride

C14H19ClF2N2O — CID 119759099

IUPAC2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1CCCC1C(=O)NCCc1cc(F)cc(F)c1
InChIInChI=1S/C14H18F2N2O.ClH/c15-10-6-9(7-11(16)8-10)4-5-18-14(19)12-2-1-3-13(12)17;/h6-8,12-13H,1-5,17H2,(H,18,19);1H
InChIKeySTGSJQBVFSKKCV-UHFFFAOYSA-N
MW304.77 g/mol
LogP2.17
Rot. Bonds4

About 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride

2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119759099) has the molecular formula C14H19ClF2N2O and a molecular weight of 304.77 g/mol. Its IUPAC name is 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119759099
Molecular FormulaC14H19ClF2N2O
Molecular Weight304.77 g/mol
Exact Mass304.12
IUPAC Name2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1CCCC1C(=O)NCCc1cc(F)cc(F)c1
InChIInChI=1S/C14H18F2N2O.ClH/c15-10-6-9(7-11(16)8-10)4-5-18-14(19)12-2-1-3-13(12)17;/h6-8,12-13H,1-5,17H2,(H,18,19);1H
InChIKeySTGSJQBVFSKKCV-UHFFFAOYSA-N
XLogP2.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.77
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[2-(4-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 64817742
2-amino-N-(3-phenylpropyl)cyclopentane-1-carboxamide
CID 64823369
2-amino-N-[(2,5-difluorophenyl)methyl]cyclopentane-1-carboxamide
CID 64823086
2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
CID 64822976
(2S,5R)-5-(aminomethyl)-N-[2-(3,5-difluorophenyl)ethyl]oxolane-2-carboxamide;hydrochloride
CID 120790695
2-amino-N-(2-fluoroethyl)cyclohexane-1-carboxamide
CID 130504072
2-amino-N-(2-thiophen-2-ylethyl)cyclopentane-1-carboxamide
CID 64816964
2-amino-N-[[3-(hydroxymethyl)phenyl]methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119775473
N-[2-(3,5-difluorophenyl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106739949
2-amino-N-(4-hydroxybutyl)cyclopentane-1-carboxamide
CID 106842187
2-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670661
3-[2-(3,5-difluorophenyl)ethylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 64835820

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride (CID 119759099) is 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride is Cl.NC1CCCC1C(=O)NCCc1cc(F)cc(F)c1.
What is the InChIKey of 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is STGSJQBVFSKKCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O.ClH/c15-10-6-9(7-11(16)8-10)4-5-18-14(19)12-2-1-3-13(12)17;/h6-8,12-13H,1-5,17H2,(H,18,19);1H.
What are the key properties of 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride?
2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 304.77 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3,5-difluorophenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119759099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).