5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide

C15H15ClN2O3S — CID 49191937

IUPAC5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NS(C)(=O)=O)c1
InChIInChI=1S/C15H15ClN2O3S/c1-10-4-3-5-12(8-10)17-15(19)13-9-11(16)6-7-14(13)18-22(2,20)21/h3-9,18H,1-2H3,(H,17,19)
InChIKeyOBHXYDIUNFVFFX-UHFFFAOYSA-N
MW338.82 g/mol
LogP3.27
Rot. Bonds4

About 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide

5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide (PubChem CID 49191937) has the molecular formula C15H15ClN2O3S and a molecular weight of 338.82 g/mol. Its IUPAC name is 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide
PubChem CID49191937
Molecular FormulaC15H15ClN2O3S
Molecular Weight338.82 g/mol
Exact Mass338.05
IUPAC Name5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2cc(Cl)ccc2NS(C)(=O)=O)c1
InChIInChI=1S/C15H15ClN2O3S/c1-10-4-3-5-12(8-10)17-15(19)13-9-11(16)6-7-14(13)18-22(2,20)21/h3-9,18H,1-2H3,(H,17,19)
InChIKeyOBHXYDIUNFVFFX-UHFFFAOYSA-N
XLogP3.27
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.82
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(3-ethylphenyl)-2-(methanesulfonamido)benzamide
CID 60606334
5-chloro-2-hydrazinyl-N-(3-methylphenyl)benzamide
CID 62236027
5-chloro-N-(3-cyclopentyloxyphenyl)-2-(methanesulfonamido)benzamide
CID 47087643
5-chloro-2-fluoro-N-[4-fluoro-3-(methanesulfonamido)phenyl]benzamide
CID 25487071
N-(2-acetyl-4-chlorophenyl)methanesulfonamide
CID 145014745
2-methyl-N-(3-methylphenyl)-5-methylsulfonylbenzamide
CID 9341567
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357
5-chloro-N-(3-chlorophenyl)-2-hydrazinylbenzamide
CID 55052324
5-chloro-2-(methanesulfonamido)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 49195493
5-chloro-N-(3,5-dimethylphenyl)-2-(methylamino)benzamide
CID 62165706
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
methyl 5-chloro-2-(methanesulfonamido)benzoate
CID 18350480

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide?
The IUPAC name of 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide (CID 49191937) is 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide?
The canonical SMILES for 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide is Cc1cccc(NC(=O)c2cc(Cl)ccc2NS(C)(=O)=O)c1.
What is the InChIKey of 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide?
The InChIKey is OBHXYDIUNFVFFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3S/c1-10-4-3-5-12(8-10)17-15(19)13-9-11(16)6-7-14(13)18-22(2,20)21/h3-9,18H,1-2H3,(H,17,19).
What are the key properties of 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide?
5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide has a molecular weight of 338.82 g/mol, XLogP of 3.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(methanesulfonamido)-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 49191937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).