1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide

C12H13ClF2N2O — CID 83087463

IUPAC1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2c(F)cc(F)cc2Cl)CCCC1
InChIInChI=1S/C12H13ClF2N2O/c13-8-5-7(14)6-9(15)10(8)17-11(18)12(16)3-1-2-4-12/h5-6H,1-4,16H2,(H,17,18)
InChIKeyARLOGRSKCGZEOY-UHFFFAOYSA-N
MW274.70 g/mol
LogP2.83
Rot. Bonds2

About 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide

1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide (PubChem CID 83087463) has the molecular formula C12H13ClF2N2O and a molecular weight of 274.70 g/mol. Its IUPAC name is 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide
PubChem CID83087463
Molecular FormulaC12H13ClF2N2O
Molecular Weight274.70 g/mol
Exact Mass274.07
IUPAC Name1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2c(F)cc(F)cc2Cl)CCCC1
InChIInChI=1S/C12H13ClF2N2O/c13-8-5-7(14)6-9(15)10(8)17-11(18)12(16)3-1-2-4-12/h5-6H,1-4,16H2,(H,17,18)
InChIKeyARLOGRSKCGZEOY-UHFFFAOYSA-N
XLogP2.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.70
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-amino-N-(2,6-dichloro-4-fluorophenyl)cyclohexane-1-carboxamide
CID 83079201
1-amino-N-(2-bromo-4,6-difluorophenyl)cyclohexane-1-carboxamide
CID 43168327
1-[(2-chloro-4,6-difluorophenyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 83087352
1-amino-N-(4-bromo-2,6-dichlorophenyl)cyclopentane-1-carboxamide
CID 60867766
1-amino-N-(2,3,5,6-tetrafluorophenyl)cyclopentane-1-carboxamide
CID 107641668
N-(2-chloro-4,6-difluorophenyl)-2-methylpiperidine-2-carboxamide
CID 104597189
N-(2-chloro-4,6-difluorophenyl)-1-cyanocyclopropane-1-carboxamide
CID 83087291
1-amino-N-(3,5-dichloro-4-fluorophenyl)cyclopentane-1-carboxamide
CID 107574361
1-amino-N-(3,5-difluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119275249
1-amino-N-(5-chloro-2-fluorophenyl)cyclopentane-1-carboxamide
CID 54925189
1-amino-N-(3,5-dichloro-4-fluorophenyl)cyclohexane-1-carboxamide
CID 107574452
1-(2-chloro-4,6-difluorophenyl)-3-methylurea
CID 21161536

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide (CID 83087463) is 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide is NC1(C(=O)Nc2c(F)cc(F)cc2Cl)CCCC1.
What is the InChIKey of 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide?
The InChIKey is ARLOGRSKCGZEOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClF2N2O/c13-8-5-7(14)6-9(15)10(8)17-11(18)12(16)3-1-2-4-12/h5-6H,1-4,16H2,(H,17,18).
What are the key properties of 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide?
1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide has a molecular weight of 274.70 g/mol, XLogP of 2.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-chloro-4,6-difluorophenyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 83087463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).