5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide

C8H8F2N2O2S2 — CID 106269106

IUPAC5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide
SMILESCN(CC(F)F)S(=O)(=O)c1ccc(C#N)s1
InChIInChI=1S/C8H8F2N2O2S2/c1-12(5-7(9)10)16(13,14)8-3-2-6(4-11)15-8/h2-3,7H,5H2,1H3
InChIKeyLLGBAFSCQZCRES-UHFFFAOYSA-N
MW266.29 g/mol
LogP1.51
Rot. Bonds4

About 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide

5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide (PubChem CID 106269106) has the molecular formula C8H8F2N2O2S2 and a molecular weight of 266.29 g/mol. Its IUPAC name is 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide
PubChem CID106269106
Molecular FormulaC8H8F2N2O2S2
Molecular Weight266.29 g/mol
Exact Mass266.00
IUPAC Name5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide
SMILESCN(CC(F)F)S(=O)(=O)c1ccc(C#N)s1
InChIInChI=1S/C8H8F2N2O2S2/c1-12(5-7(9)10)16(13,14)8-3-2-6(4-11)15-8/h2-3,7H,5H2,1H3
InChIKeyLLGBAFSCQZCRES-UHFFFAOYSA-N
XLogP1.51
TPSA61.17 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-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

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide (CID 106269106) is 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide is CN(CC(F)F)S(=O)(=O)c1ccc(C#N)s1.
What is the InChIKey of 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide?
The InChIKey is LLGBAFSCQZCRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O2S2/c1-12(5-7(9)10)16(13,14)8-3-2-6(4-11)15-8/h2-3,7H,5H2,1H3.
What are the key properties of 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide?
5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide has a molecular weight of 266.29 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(2,2-difluoroethyl)-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 106269106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).