2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

C16H15F3N2O3S — CID 58198420

IUPAC2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(C)(C(=O)Nc1cccc(C(F)(F)F)n1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C16H15F3N2O3S/c1-15(2,25(23,24)11-7-4-3-5-8-11)14(22)21-13-10-6-9-12(20-13)16(17,18)19/h3-10H,1-2H3,(H,20,21,22)
InChIKeyPZMPKJDZJPAWJL-UHFFFAOYSA-N
MW372.37 g/mol
LogP3.29
Rot. Bonds4

About 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (PubChem CID 58198420) has the molecular formula C16H15F3N2O3S and a molecular weight of 372.37 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
PubChem CID58198420
Molecular FormulaC16H15F3N2O3S
Molecular Weight372.37 g/mol
Exact Mass372.08
IUPAC Name2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(C)(C(=O)Nc1cccc(C(F)(F)F)n1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C16H15F3N2O3S/c1-15(2,25(23,24)11-7-4-3-5-8-11)14(22)21-13-10-6-9-12(20-13)16(17,18)19/h3-10H,1-2H3,(H,20,21,22)
InChIKeyPZMPKJDZJPAWJL-UHFFFAOYSA-N
XLogP3.29
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The IUPAC name of 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (CID 58198420) is 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The canonical SMILES for 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is CC(C)(C(=O)Nc1cccc(C(F)(F)F)n1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The InChIKey is PZMPKJDZJPAWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O3S/c1-15(2,25(23,24)11-7-4-3-5-8-11)14(22)21-13-10-6-9-12(20-13)16(17,18)19/h3-10H,1-2H3,(H,20,21,22).
What are the key properties of 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide has a molecular weight of 372.37 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-2-methyl-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 58198420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).