N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide

C12H11F3N2O3S — CID 86794026

IUPACN-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide
SMILESCc1cc(NS(=O)(=O)Cc2ccccc2C(F)(F)F)no1
InChIInChI=1S/C12H11F3N2O3S/c1-8-6-11(16-20-8)17-21(18,19)7-9-4-2-3-5-10(9)12(13,14)15/h2-6H,7H2,1H3,(H,16,17)
InChIKeyOWHOLNTWDSKGMT-UHFFFAOYSA-N
MW320.29 g/mol
LogP2.94
Rot. Bonds4

About N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide

N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide (PubChem CID 86794026) has the molecular formula C12H11F3N2O3S and a molecular weight of 320.29 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide
PubChem CID86794026
Molecular FormulaC12H11F3N2O3S
Molecular Weight320.29 g/mol
Exact Mass320.04
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide
SMILESCc1cc(NS(=O)(=O)Cc2ccccc2C(F)(F)F)no1
InChIInChI=1S/C12H11F3N2O3S/c1-8-6-11(16-20-8)17-21(18,19)7-9-4-2-3-5-10(9)12(13,14)15/h2-6H,7H2,1H3,(H,16,17)
InChIKeyOWHOLNTWDSKGMT-UHFFFAOYSA-N
XLogP2.94
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.29
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide 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

N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-[[2-(trifluoromethyl)phenyl]methyl]amino]butanamide
CID 55544203
5-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]-1,2-oxazole-3-carboxamide
CID 86166953
N-(5-methyl-1,2-oxazol-3-yl)-3-(trifluoromethyl)benzenesulfonamide
CID 8519021
5-methyl-3-[[(R)-[2-(trifluoromethyl)phenyl]methylsulfinyl]methyl]-1,2-oxazole
CID 95062171
4-[(5-methyl-1,2-oxazol-3-yl)sulfamoylmethyl]benzoic acid
CID 43362452
N-(2-aminoethyl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide
CID 120998849
N-(2,3-dihydrofuro[3,2-c]pyridin-4-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide
CID 167989466
N-(5-methyl-1,2-oxazol-3-yl)butane-1-sulfonamide
CID 6465435
[2-(trifluoromethyl)phenyl]methanesulfonic acid
CID 86065127
4-methyl-N-[methyl-oxo-[[2-(trifluoromethyl)phenyl]methyl]-λ6-sulfanylidene]benzenesulfonamide
CID 162396758
2-fluoro-N-[2-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]ethyl]benzamide
CID 110345062
1-N'-(5-methyl-1,2-oxazol-3-yl)-1-N-[2-(trifluoromethyl)phenyl]cyclopropane-1,1-dicarboxamide
CID 108983363

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide (CID 86794026) is N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide is Cc1cc(NS(=O)(=O)Cc2ccccc2C(F)(F)F)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide?
The InChIKey is OWHOLNTWDSKGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2O3S/c1-8-6-11(16-20-8)17-21(18,19)7-9-4-2-3-5-10(9)12(13,14)15/h2-6H,7H2,1H3,(H,16,17).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide?
N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide has a molecular weight of 320.29 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-1-[2-(trifluoromethyl)phenyl]methanesulfonamide is sourced from PubChem (CID 86794026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).