N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide

C15H13F3N2O4S — CID 3715374

IUPACN-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide
SMILESCNC(=O)c1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O4S/c1-19-14(21)10-6-8-11(9-7-10)20-25(22,23)13-5-3-2-4-12(13)24-15(16,17)18/h2-9,20H,1H3,(H,19,21)
InChIKeyGXYMFXGGXWOCRF-UHFFFAOYSA-N
MW374.34 g/mol
LogP2.75
Rot. Bonds5

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

N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide (PubChem CID 3715374) has the molecular formula C15H13F3N2O4S and a molecular weight of 374.34 g/mol. Its IUPAC name is N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide.

Molecular Properties

Compound NameN-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide
PubChem CID3715374
Molecular FormulaC15H13F3N2O4S
Molecular Weight374.34 g/mol
Exact Mass374.05
IUPAC NameN-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide
SMILESCNC(=O)c1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O4S/c1-19-14(21)10-6-8-11(9-7-10)20-25(22,23)13-5-3-2-4-12(13)24-15(16,17)18/h2-9,20H,1H3,(H,19,21)
InChIKeyGXYMFXGGXWOCRF-UHFFFAOYSA-N
XLogP2.75
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.34
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzoic acid
CID 18274848
2,2-dimethyl-N-[4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]phenyl]propanamide
CID 35185568
methyl 2-methoxy-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzoate
CID 3811980
2-(trifluoromethoxy)-N-[2-(trifluoromethoxy)phenyl]benzenesulfonamide
CID 31071215
N-[4-methoxy-3-(trifluoromethyl)phenyl]-2-(trifluoromethoxy)benzenesulfonamide
CID 3841687
N-(4-acetylphenyl)-4-bromo-2-(trifluoromethoxy)benzenesulfonamide
CID 20815752
2-methoxy-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 2538540
1-phenyl-3-[3-[[2-(trifluoromethoxy)phenyl]sulfonylamino]phenyl]urea
CID 25348337
4-(methanesulfonamido)-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 41479006
methyl 4-methoxy-3-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzoate
CID 3481209
N-(2,6-diethylphenyl)-2-(trifluoromethoxy)benzenesulfonamide
CID 112808737
N,4-dimethyl-3-(phenylsulfamoyl)benzamide
CID 3894784

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide?
The IUPAC name of N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide (CID 3715374) is N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide.
What is the SMILES notation for N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide?
The canonical SMILES for N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide is CNC(=O)c1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc1.
What is the InChIKey of N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide?
The InChIKey is GXYMFXGGXWOCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O4S/c1-19-14(21)10-6-8-11(9-7-10)20-25(22,23)13-5-3-2-4-12(13)24-15(16,17)18/h2-9,20H,1H3,(H,19,21).
What are the key properties of N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide?
N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide has a molecular weight of 374.34 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[[2-(trifluoromethoxy)phenyl]sulfonylamino]benzamide is sourced from PubChem (CID 3715374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).