2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide

C15H13F3N2O3S — CID 26950715

IUPAC2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide
SMILESCN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O3S/c1-20(13-5-3-2-4-12(13)14(19)21)24(22,23)11-8-6-10(7-9-11)15(16,17)18/h2-9H,1H3,(H2,19,21)
InChIKeyIDGMWESNJHJPOW-UHFFFAOYSA-N
MW358.34 g/mol
LogP2.63
Rot. Bonds4

About 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide

2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide (PubChem CID 26950715) has the molecular formula C15H13F3N2O3S and a molecular weight of 358.34 g/mol. Its IUPAC name is 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound Name2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide
PubChem CID26950715
Molecular FormulaC15H13F3N2O3S
Molecular Weight358.34 g/mol
Exact Mass358.06
IUPAC Name2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide
SMILESCN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O3S/c1-20(13-5-3-2-4-12(13)14(19)21)24(22,23)11-8-6-10(7-9-11)15(16,17)18/h2-9H,1H3,(H2,19,21)
InChIKeyIDGMWESNJHJPOW-UHFFFAOYSA-N
XLogP2.63
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 951596
2-[[4-[(2R)-butan-2-yl]phenyl]sulfonyl-methylamino]benzamide
CID 26950706
2-[(2,6-difluorophenyl)sulfonyl-methylamino]benzamide
CID 31579746
N,N-dimethyl-2-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 27055363
2-[benzenesulfonyl(methyl)amino]-N-[2-(trifluoromethyl)phenyl]benzamide
CID 1294778
2-[methyl-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonyl]amino]benzamide
CID 24602631
carbon dioxide;N-methyl-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 159596379
N-[2-chloro-5-(trifluoromethyl)phenyl]-N-methylbenzenesulfonamide
CID 84511027
2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl-methylamino]benzamide
CID 17436993
4-acetyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-N-methylbenzenesulfonamide
CID 110604269
2-[2-[[3,5-bis(trifluoromethyl)phenyl]sulfonyl-methylamino]-4-(trifluoromethyl)phenoxy]benzoic acid
CID 19430560
2-[4-(trifluoromethyl)benzenecarbothioyl]benzamide
CID 87378591

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The IUPAC name of 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide (CID 26950715) is 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The canonical SMILES for 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide is CN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The InChIKey is IDGMWESNJHJPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O3S/c1-20(13-5-3-2-4-12(13)14(19)21)24(22,23)11-8-6-10(7-9-11)15(16,17)18/h2-9H,1H3,(H2,19,21).
What are the key properties of 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide has a molecular weight of 358.34 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 26950715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).