2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide

C16H15F3N2O3S — CID 1296417

IUPAC2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C16H15F3N2O3S/c1-11-2-8-14(9-3-11)25(23,24)20-10-15(22)21-13-6-4-12(5-7-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyCJBALCQYAAHELW-UHFFFAOYSA-N
MW372.37 g/mol
LogP2.93
Rot. Bonds5

About 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide

2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 1296417) has the molecular formula C16H15F3N2O3S and a molecular weight of 372.37 g/mol. Its IUPAC name is 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID1296417
Molecular FormulaC16H15F3N2O3S
Molecular Weight372.37 g/mol
Exact Mass372.08
IUPAC Name2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C16H15F3N2O3S/c1-11-2-8-14(9-3-11)25(23,24)20-10-15(22)21-13-6-4-12(5-7-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22)
InChIKeyCJBALCQYAAHELW-UHFFFAOYSA-N
XLogP2.93
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.37
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide 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-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide (CID 1296417) is 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide is Cc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is CJBALCQYAAHELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O3S/c1-11-2-8-14(9-3-11)25(23,24)20-10-15(22)21-13-6-4-12(5-7-13)16(17,18)19/h2-9,20H,10H2,1H3,(H,21,22).
What are the key properties of 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide?
2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 372.37 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)sulfonylamino]-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 1296417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).