N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide

C21H20N2O3S — CID 21236527

IUPACN-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C21H20N2O3S/c1-22(18-9-5-3-6-10-18)21(24)17-13-15-20(16-14-17)27(25,26)23(2)19-11-7-4-8-12-19/h3-16H,1-2H3
InChIKeyPDSAXUDKTCLXHB-UHFFFAOYSA-N
MW380.47 g/mol
LogP3.79
Rot. Bonds5

About N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide

N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide (PubChem CID 21236527) has the molecular formula C21H20N2O3S and a molecular weight of 380.47 g/mol. Its IUPAC name is N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound NameN-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
PubChem CID21236527
Molecular FormulaC21H20N2O3S
Molecular Weight380.47 g/mol
Exact Mass380.12
IUPAC NameN-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C21H20N2O3S/c1-22(18-9-5-3-6-10-18)21(24)17-13-15-20(16-14-17)27(25,26)23(2)19-11-7-4-8-12-19/h3-16H,1-2H3
InChIKeyPDSAXUDKTCLXHB-UHFFFAOYSA-N
XLogP3.79
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-[methyl-(4-methylphenyl)sulfamoyl]-N-phenylbenzamide
CID 26536520
N-benzyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 9098551
4-[methyl(phenyl)sulfamoyl]-N,N-bis(prop-2-enyl)benzamide
CID 78784352
4-[benzenesulfonyl(methyl)amino]benzoic acid
CID 804306
N-butyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide
CID 8839615
N-(1-aminopropan-2-yl)-N-methyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 119583533
4-[methyl(phenyl)sulfamoyl]-N-propylbenzamide
CID 2432115
4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 1226832
N-(4-acetylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2597397
N-butyl-N-(2-hydroxyethyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 78856047
4-(anilinocarbamoyl)-N-methyl-N-phenylbenzenesulfonamide
CID 78774991
N-cyclohexyl-N-ethyl-4-[methyl(phenyl)sulfamoyl]benzamide
CID 24632491

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide?
The IUPAC name of N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide (CID 21236527) is N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide?
The canonical SMILES for N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide is CN(C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide?
The InChIKey is PDSAXUDKTCLXHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3S/c1-22(18-9-5-3-6-10-18)21(24)17-13-15-20(16-14-17)27(25,26)23(2)19-11-7-4-8-12-19/h3-16H,1-2H3.
What are the key properties of N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide?
N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide has a molecular weight of 380.47 g/mol, XLogP of 3.79, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[methyl(phenyl)sulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 21236527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).