N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide

C17H19ClN2O3S — CID 8780488

IUPACN-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)N(C)C)cc1C(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O3S/c1-11-8-9-13(24(22,23)20(3)4)10-14(11)17(21)19-16-7-5-6-15(18)12(16)2/h5-10H,1-4H3,(H,19,21)
InChIKeyLUNAPLXQLFEKOF-UHFFFAOYSA-N
MW366.87 g/mol
LogP3.46
Rot. Bonds4

About N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide

N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide (PubChem CID 8780488) has the molecular formula C17H19ClN2O3S and a molecular weight of 366.87 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide
PubChem CID8780488
Molecular FormulaC17H19ClN2O3S
Molecular Weight366.87 g/mol
Exact Mass366.08
IUPAC NameN-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide
SMILESCc1ccc(S(=O)(=O)N(C)C)cc1C(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O3S/c1-11-8-9-13(24(22,23)20(3)4)10-14(11)17(21)19-16-7-5-6-15(18)12(16)2/h5-10H,1-4H3,(H,19,21)
InChIKeyLUNAPLXQLFEKOF-UHFFFAOYSA-N
XLogP3.46
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.87
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297779
2-chloro-N-(2-chlorophenyl)-5-(dimethylsulfamoyl)benzamide
CID 1310418
2-chloro-N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]benzamide
CID 16564311
2-chloro-5-(dimethylsulfamoyl)-N-(2-iodophenyl)benzamide
CID 3413626
2-chloro-5-(dimethylsulfamoyl)-N-(5-fluoro-2-methylphenyl)benzamide
CID 4650179
N-(2-acetylphenyl)-2-chloro-5-(dimethylsulfamoyl)benzamide
CID 4800969
N-(5-acetyl-2-methylphenyl)-2-chloro-5-(dimethylsulfamoyl)benzamide
CID 110618400
2-chloro-N-(3-chloro-4-methylphenyl)-5-(dimethylsulfamoyl)benzamide
CID 2665830
2-chloro-N-[5-(dimethylsulfamoyl)-2-methylphenyl]-4-fluorobenzamide
CID 26522089
N-(2,3-dimethylphenyl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26538419
N-(3-chloro-2,6-diethylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide
CID 8920403
2-[[5-(dimethylsulfamoyl)-2-methylphenyl]carbamoyl]benzoic acid
CID 2813889

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide (CID 8780488) is N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide is Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)Nc1cccc(Cl)c1C.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide?
The InChIKey is LUNAPLXQLFEKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3S/c1-11-8-9-13(24(22,23)20(3)4)10-14(11)17(21)19-16-7-5-6-15(18)12(16)2/h5-10H,1-4H3,(H,19,21).
What are the key properties of N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide?
N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide has a molecular weight of 366.87 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-5-(dimethylsulfamoyl)-2-methylbenzamide is sourced from PubChem (CID 8780488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).