5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide

C6H4F3NO3S2 — CID 14909930

IUPAC5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C(=O)C(F)(F)F)s1
InChIInChI=1S/C6H4F3NO3S2/c7-6(8,9)5(11)3-1-2-4(14-3)15(10,12)13/h1-2H,(H2,10,12,13)
InChIKeyRSTFQMCVUIDRTJ-UHFFFAOYSA-N
MW259.23 g/mol
LogP1.14
Rot. Bonds2

About 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide

5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide (PubChem CID 14909930) has the molecular formula C6H4F3NO3S2 and a molecular weight of 259.23 g/mol. Its IUPAC name is 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide
PubChem CID14909930
Molecular FormulaC6H4F3NO3S2
Molecular Weight259.23 g/mol
Exact Mass258.96
IUPAC Name5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide
SMILESNS(=O)(=O)c1ccc(C(=O)C(F)(F)F)s1
InChIInChI=1S/C6H4F3NO3S2/c7-6(8,9)5(11)3-1-2-4(14-3)15(10,12)13/h1-2H,(H2,10,12,13)
InChIKeyRSTFQMCVUIDRTJ-UHFFFAOYSA-N
XLogP1.14
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide 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

7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonic acid amide
CID 13763156
7-Oxo-6,7-dihydro-5H-thieno[3,2-b]thiopyran-2-sulfonamide 4,4-dioxide
CID 13763159
5-Formylthiophene-2-sulfonamide
CID 83483945
2-(Benzenesulfonyl)-2,2-difluoro-1-thiophen-2-ylethanone
CID 162414096
Sodium 5-acetylthiophene-2-sulfonate
CID 23685539
3-(2,2,2-Trifluoroacetyl)thiophene-2-sulfonamide
CID 67314937
5-(4,4,4-Trifluoro-3-oxobutanoyl)thiophene-2-sulfonyl chloride
CID 71346117
[5-(2,2,2-Trifluoroacetyl)thiophen-2-yl]sulfonylformamide
CID 87356571
5-(4,4,4-Trifluoro-3-oxobutanoyl)thiophene-2-sulfonic acid
CID 87530748
5-(2,2,4-Trifluoro-3-oxobutanoyl)thiophene-2-sulfonyl chloride
CID 89400412
5-(2,4,4-Trifluoro-3-oxobutanoyl)thiophene-2-sulfonyl chloride
CID 89400413
Methyl 5-(4,4,4-trifluoro-3-oxobutanoyl)thiophene-2-sulfonate
CID 90764033

Frequently Asked Questions

What is the IUPAC name of 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide?
The IUPAC name of 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide (CID 14909930) is 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide?
The canonical SMILES for 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide is NS(=O)(=O)c1ccc(C(=O)C(F)(F)F)s1.
What is the InChIKey of 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide?
The InChIKey is RSTFQMCVUIDRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3NO3S2/c7-6(8,9)5(11)3-1-2-4(14-3)15(10,12)13/h1-2H,(H2,10,12,13).
What are the key properties of 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide?
5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide has a molecular weight of 259.23 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2,2-trifluoroacetyl)thiophene-2-sulfonamide is sourced from PubChem (CID 14909930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).