N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

C17H20N2O3S — CID 51297738

IUPACN-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(C)cc2C)c1
InChIInChI=1S/C17H20N2O3S/c1-11-5-8-16(13(3)9-11)19-17(20)15-10-14(7-6-12(15)2)23(21,22)18-4/h5-10,18H,1-4H3,(H,19,20)
InChIKeyBCEALWPVSAMBIO-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.77
Rot. Bonds4

About N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide

N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (PubChem CID 51297738) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
PubChem CID51297738
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
SMILESCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(C)cc2C)c1
InChIInChI=1S/C17H20N2O3S/c1-11-5-8-16(13(3)9-11)19-17(20)15-10-14(7-6-12(15)2)23(21,22)18-4/h5-10,18H,1-4H3,(H,19,20)
InChIKeyBCEALWPVSAMBIO-UHFFFAOYSA-N
XLogP2.77
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-(3-methylphenyl)-5-(methylsulfamoyl)benzamide
CID 51297733
5-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)-2-methylbenzamide
CID 53281830
N-(2,4-dimethylphenyl)-2-methyl-5-(4-methylpiperazin-1-yl)sulfonylbenzamide
CID 99968828
N-(2,5-dimethylphenyl)-2-methyl-5-methylsulfonylbenzamide
CID 26909371
5-(tert-butylsulfamoyl)-N-(2-hydroxy-4-methylphenyl)-2-methylbenzamide
CID 51166421
N-(3-chloro-2-methylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297779
N-(2-hydroxy-4-methylphenyl)-5-(2-methoxyethylsulfamoyl)-2-methylbenzamide
CID 46652713
N-(2-bromo-4-methylphenyl)-5-(diethylsulfamoyl)-2-methylbenzamide
CID 26524150
N-(2-chloro-4-methylphenyl)-2,5-dimethylbenzamide
CID 2549224
N-(4-ethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide
CID 51297821
N-(4-iodo-2-methylphenyl)-4-(methylsulfamoyl)benzamide
CID 55407314
5-(tert-butylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-2-methylbenzamide
CID 26414248

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide (CID 51297738) is N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is CNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(C)cc2C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
The InChIKey is BCEALWPVSAMBIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-11-5-8-16(13(3)9-11)19-17(20)15-10-14(7-6-12(15)2)23(21,22)18-4/h5-10,18H,1-4H3,(H,19,20).
What are the key properties of N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide?
N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-methyl-5-(methylsulfamoyl)benzamide is sourced from PubChem (CID 51297738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).