N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

C16H17ClN2O3S — CID 51297779

IUPACN-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C16H17ClN2O3S/c1-10-7-8-12(23(21,22)18-3)9-13(10)16(20)19-15-6-4-5-14(17)11(15)2/h4-9,18H,1-3H3,(H,19,20)
InChIKeyUWMHDYHZYPUFBP-UHFFFAOYSA-N
MW352.84 g/mol
LogP3.12
Rot. Bonds4

About N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (PubChem CID 51297779) has the molecular formula C16H17ClN2O3S and a molecular weight of 352.84 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
PubChem CID51297779
Molecular FormulaC16H17ClN2O3S
Molecular Weight352.84 g/mol
Exact Mass352.06
IUPAC NameN-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(Cl)c2C)c1
InChIInChI=1S/C16H17ClN2O3S/c1-10-7-8-12(23(21,22)18-3)9-13(10)16(20)19-15-6-4-5-14(17)11(15)2/h4-9,18H,1-3H3,(H,19,20)
InChIKeyUWMHDYHZYPUFBP-UHFFFAOYSA-N
XLogP3.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide
CID 8780488
N-(2-chlorophenyl)-5-(ethylsulfamoyl)-2-methylbenzamide
CID 35345609
N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297738
2-methyl-N-(3-methylphenyl)-5-(methylsulfamoyl)benzamide
CID 51297733
5-(benzylsulfamoyl)-N-(2-chlorophenyl)-2-methylbenzamide
CID 30281742
N-(2,3-dimethylphenyl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26538419
N-(3-chloro-2-methylphenyl)-2-fluoro-5-(2-phenylethylsulfamoyl)benzamide
CID 15994437
N-(3-chloro-2-methylphenyl)-2-[2-(2-methoxyethylamino)-5-(methylsulfamoyl)anilino]acetamide
CID 71849298
N-(3-chloro-2-methylphenyl)-2,5-dimethylthiophene-3-carboxamide
CID 29203485
N-(3-chloro-2-methylphenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 3452162
2-chloro-N-(3-chlorophenyl)-5-(methylsulfamoyl)benzamide
CID 9412137
N-(3-chloro-2-pyrazol-1-ylphenyl)-2-methyl-5-methylsulfonylbenzamide
CID 87007049

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (CID 51297779) is N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(Cl)c2C)c1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The InChIKey is UWMHDYHZYPUFBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3S/c1-10-7-8-12(23(21,22)18-3)9-13(10)16(20)19-15-6-4-5-14(17)11(15)2/h4-9,18H,1-3H3,(H,19,20).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide has a molecular weight of 352.84 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 51297779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).