N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide

C18H18ClFN2O3S — CID 55577445

IUPACN-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(F)cc1Cl)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C18H18ClFN2O3S/c19-16-11-13(20)8-9-17(16)21-18(23)12-4-3-7-15(10-12)26(24,25)22-14-5-1-2-6-14/h3-4,7-11,14,22H,1-2,5-6H2,(H,21,23)
InChIKeyCTYSCQYSIAWYHW-UHFFFAOYSA-N
MW396.87 g/mol
LogP3.95
Rot. Bonds5

About N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide

N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide (PubChem CID 55577445) has the molecular formula C18H18ClFN2O3S and a molecular weight of 396.87 g/mol. Its IUPAC name is N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide
PubChem CID55577445
Molecular FormulaC18H18ClFN2O3S
Molecular Weight396.87 g/mol
Exact Mass396.07
IUPAC NameN-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide
SMILESO=C(Nc1ccc(F)cc1Cl)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C18H18ClFN2O3S/c19-16-11-13(20)8-9-17(16)21-18(23)12-4-3-7-15(10-12)26(24,25)22-14-5-1-2-6-14/h3-4,7-11,14,22H,1-2,5-6H2,(H,21,23)
InChIKeyCTYSCQYSIAWYHW-UHFFFAOYSA-N
XLogP3.95
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.87
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopentylsulfamoyl)-N-(2-fluorophenyl)benzamide
CID 109063181
N-(5-chloro-2-fluorophenyl)-3-(cyclopropylsulfamoyl)benzamide
CID 94006212
5-[[3-(cyclopentylsulfamoyl)benzoyl]amino]-2,4-difluorobenzamide
CID 56570757
4-[[3-(cyclopentylsulfamoyl)benzoyl]amino]-N,3-dimethylbenzamide
CID 46465029
N-(5-amino-2-methylphenyl)-3-(cyclopentylsulfamoyl)benzamide;hydrochloride
CID 120568619
4-chloro-N-[4-(cyclopentylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892580
3-(cyclohexylsulfamoyl)-N-cyclopentylbenzamide
CID 109063195
3-(cyclohexylsulfamoyl)-N-(2-ethylphenyl)benzamide
CID 109063388
N-[3-(cyclopropylsulfamoyl)phenyl]-3-fluorobenzamide
CID 17404523
4-chloro-N-[4-(cyclooctylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892724
4-chloro-N-[4-(cyclohexylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892581
N-[3-chloro-2-(dimethylamino)phenyl]-3-(cyclopropylsulfamoyl)benzamide
CID 55763086

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide?
The IUPAC name of N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide (CID 55577445) is N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide?
The canonical SMILES for N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide is O=C(Nc1ccc(F)cc1Cl)c1cccc(S(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide?
The InChIKey is CTYSCQYSIAWYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClFN2O3S/c19-16-11-13(20)8-9-17(16)21-18(23)12-4-3-7-15(10-12)26(24,25)22-14-5-1-2-6-14/h3-4,7-11,14,22H,1-2,5-6H2,(H,21,23).
What are the key properties of N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide?
N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide has a molecular weight of 396.87 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)benzamide is sourced from PubChem (CID 55577445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).