N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide

C15H13F3N2O3S — CID 24502255

IUPACN-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H13F3N2O3S/c1-19-14(21)12-7-2-3-8-13(12)20-24(22,23)11-6-4-5-10(9-11)15(16,17)18/h2-9,20H,1H3,(H,19,21)
InChIKeyFIEKIQLVLKLKJV-UHFFFAOYSA-N
MW358.34 g/mol
LogP2.87
Rot. Bonds4

About N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide

N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide (PubChem CID 24502255) has the molecular formula C15H13F3N2O3S and a molecular weight of 358.34 g/mol. Its IUPAC name is N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
PubChem CID24502255
Molecular FormulaC15H13F3N2O3S
Molecular Weight358.34 g/mol
Exact Mass358.06
IUPAC NameN-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
SMILESCNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C15H13F3N2O3S/c1-19-14(21)12-7-2-3-8-13(12)20-24(22,23)11-6-4-5-10(9-11)15(16,17)18/h2-9,20H,1H3,(H,19,21)
InChIKeyFIEKIQLVLKLKJV-UHFFFAOYSA-N
XLogP2.87
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,2-dimethylpropanoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 135058672
N,N-dimethyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 25494632
N-benzhydryl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 2333973
N-(3-hydroxypropyl)-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 78843246
N-(pyridin-3-ylmethyl)-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 2336757
N-[[6-(dimethylamino)-3-pyridinyl]methyl]-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide
CID 55621279
N-[2-(morpholine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 31813108
N-[2-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 30825076
N-(2-methylsulfinylphenyl)-3-(trifluoromethyl)benzenesulfonamide
CID 14536122
1-methyl-3-[3-(trifluoromethyl)phenyl]sulfonylurea
CID 23548404
N-[2-(2-methylmorpholine-4-carbonyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide
CID 24666353
N-(2-prop-2-enylsulfonylphenyl)-3-(trifluoromethyl)benzenesulfonamide
CID 14536163

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The IUPAC name of N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide (CID 24502255) is N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The canonical SMILES for N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide is CNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
The InChIKey is FIEKIQLVLKLKJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O3S/c1-19-14(21)12-7-2-3-8-13(12)20-24(22,23)11-6-4-5-10(9-11)15(16,17)18/h2-9,20H,1H3,(H,19,21).
What are the key properties of N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide?
N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide has a molecular weight of 358.34 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 24502255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).