4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide

C16H15F3N2O3S — CID 2474371

IUPAC4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C16H15F3N2O3S/c1-21(2)25(23,24)12-9-7-11(8-10-12)15(22)20-14-6-4-3-5-13(14)16(17,18)19/h3-10H,1-2H3,(H,20,22)
InChIKeyQGBLZQYPOZORIR-UHFFFAOYSA-N
MW372.37 g/mol
LogP3.21
Rot. Bonds4

About 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide

4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide (PubChem CID 2474371) has the molecular formula C16H15F3N2O3S and a molecular weight of 372.37 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide
PubChem CID2474371
Molecular FormulaC16H15F3N2O3S
Molecular Weight372.37 g/mol
Exact Mass372.08
IUPAC Name4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1
InChIInChI=1S/C16H15F3N2O3S/c1-21(2)25(23,24)12-9-7-11(8-10-12)15(22)20-14-6-4-3-5-13(14)16(17,18)19/h3-10H,1-2H3,(H,20,22)
InChIKeyQGBLZQYPOZORIR-UHFFFAOYSA-N
XLogP3.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.37
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[dimethylsulfamoyl(methyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 92664146
2-[[4-(dimethylsulfamoyl)benzoyl]amino]-N-(2,2,2-trifluoroethyl)benzamide
CID 17426970
4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 2984505
N-(2-tert-butylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 7920184
4-benzoyl-N-[2-(trifluoromethyl)phenyl]benzamide
CID 610570
N-[4-(dimethylsulfamoyl)phenyl]-2-[ethyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]acetamide
CID 2462034
2-[benzenesulfonyl(methyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 1294778
4-(dimethylsulfamoyl)-N-(4-hydroxynaphthalen-1-yl)benzamide
CID 17460385
[4-[[2-(trifluoromethyl)phenyl]carbamoyl]phenyl]boronic acid
CID 44717648
4-(benzamidocarbamoyl)-N,N-dimethylbenzenesulfonamide
CID 3304166
4-phenoxy-N-[2-(trifluoromethyl)phenyl]benzamide
CID 16651583
N-(5-chloro-2-fluorophenyl)-4-(dimethylsulfamoyl)benzamide
CID 2664664

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide (CID 2474371) is 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is QGBLZQYPOZORIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O3S/c1-21(2)25(23,24)12-9-7-11(8-10-12)15(22)20-14-6-4-3-5-13(14)16(17,18)19/h3-10H,1-2H3,(H,20,22).
What are the key properties of 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide?
4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 372.37 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 2474371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).