2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide

C15H13F3N2O3S — CID 1316427

IUPAC2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O3S/c16-15(17,18)11-6-8-12(9-7-11)20-14(21)10-19-24(22,23)13-4-2-1-3-5-13/h1-9,19H,10H2,(H,20,21)
InChIKeyOXINMFSDSHDHMI-UHFFFAOYSA-N
MW358.34 g/mol
LogP2.62
Rot. Bonds5

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

2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 1316427) has the molecular formula C15H13F3N2O3S and a molecular weight of 358.34 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID1316427
Molecular FormulaC15H13F3N2O3S
Molecular Weight358.34 g/mol
Exact Mass358.06
IUPAC Name2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESO=C(CNS(=O)(=O)c1ccccc1)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H13F3N2O3S/c16-15(17,18)11-6-8-12(9-7-11)20-14(21)10-19-24(22,23)13-4-2-1-3-5-13/h1-9,19H,10H2,(H,20,21)
InChIKeyOXINMFSDSHDHMI-UHFFFAOYSA-N
XLogP2.62
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide (CID 1316427) is 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide is O=C(CNS(=O)(=O)c1ccccc1)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is OXINMFSDSHDHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O3S/c16-15(17,18)11-6-8-12(9-7-11)20-14(21)10-19-24(22,23)13-4-2-1-3-5-13/h1-9,19H,10H2,(H,20,21).
What are the key properties of 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide?
2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 358.34 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 1316427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).