N-(2-chloro-5-methylsulfonylphenyl)benzamide

C14H12ClNO3S — CID 8913636

IUPACN-(2-chloro-5-methylsulfonylphenyl)benzamide
SMILESCS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C14H12ClNO3S/c1-20(18,19)11-7-8-12(15)13(9-11)16-14(17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)
InChIKeyKKXPGIOGIANUAG-UHFFFAOYSA-N
MW309.77 g/mol
LogP3.00
Rot. Bonds3

About N-(2-chloro-5-methylsulfonylphenyl)benzamide

N-(2-chloro-5-methylsulfonylphenyl)benzamide (PubChem CID 8913636) has the molecular formula C14H12ClNO3S and a molecular weight of 309.77 g/mol. Its IUPAC name is N-(2-chloro-5-methylsulfonylphenyl)benzamide.

Molecular Properties

Compound NameN-(2-chloro-5-methylsulfonylphenyl)benzamide
PubChem CID8913636
Molecular FormulaC14H12ClNO3S
Molecular Weight309.77 g/mol
Exact Mass309.02
IUPAC NameN-(2-chloro-5-methylsulfonylphenyl)benzamide
SMILESCS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C14H12ClNO3S/c1-20(18,19)11-7-8-12(15)13(9-11)16-14(17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)
InChIKeyKKXPGIOGIANUAG-UHFFFAOYSA-N
XLogP3.00
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.77
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-5-methylsulfonylphenyl)-3-methylbenzamide
CID 8913728
4-chloro-3-[(4-phenylbenzoyl)amino]benzenesulfonic acid
CID 139946841
3-(2-chloro-5-methylsulfonylanilino)-3-oxopropanoic acid
CID 62232235
N-(2-chloro-5-methylsulfonylphenyl)-6-fluoropyridine-3-carboxamide
CID 63973961
N-(2-chloro-5-methylsulfonylphenyl)-6-methylpyridine-2-carboxamide
CID 31930381
N-(2,5-dichlorophenyl)benzamide;hydroiodide
CID 175991469
3,4-dichloro-N-(2-methyl-5-methylsulfonylphenyl)benzamide
CID 27990929
N-(2-chloro-5-methylsulfonylphenyl)-4-(1,3-oxazol-5-yl)benzamide
CID 75479712
2-chloro-N-(2-chloro-5-methylsulfonylphenyl)furan-3-carboxamide
CID 106685589
N-(2-chloro-5-methylsulfonylphenyl)-2,2-difluoroacetamide
CID 113218224
2-bromo-N-(2-chloro-5-methylsulfonylphenyl)acetamide
CID 60651950
N-[2-chloro-5-[(2-chlorophenyl)sulfamoyl]phenyl]-4-(phenylsulfamoyl)benzamide
CID 4049236

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-methylsulfonylphenyl)benzamide?
The IUPAC name of N-(2-chloro-5-methylsulfonylphenyl)benzamide (CID 8913636) is N-(2-chloro-5-methylsulfonylphenyl)benzamide.
What is the SMILES notation for N-(2-chloro-5-methylsulfonylphenyl)benzamide?
The canonical SMILES for N-(2-chloro-5-methylsulfonylphenyl)benzamide is CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-(2-chloro-5-methylsulfonylphenyl)benzamide?
The InChIKey is KKXPGIOGIANUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO3S/c1-20(18,19)11-7-8-12(15)13(9-11)16-14(17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17).
What are the key properties of N-(2-chloro-5-methylsulfonylphenyl)benzamide?
N-(2-chloro-5-methylsulfonylphenyl)benzamide has a molecular weight of 309.77 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-methylsulfonylphenyl)benzamide is sourced from PubChem (CID 8913636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).