2-(2-fluorophenyl)-N-methylbenzenesulfonamide

C13H12FNO2S — CID 54673209

IUPAC2-(2-fluorophenyl)-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1-c1ccccc1F
InChIInChI=1S/C13H12FNO2S/c1-15-18(16,17)13-9-5-3-7-11(13)10-6-2-4-8-12(10)14/h2-9,15H,1H3
InChIKeyDAXGGHUKVIWZFW-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.40
Rot. Bonds3

About 2-(2-fluorophenyl)-N-methylbenzenesulfonamide

2-(2-fluorophenyl)-N-methylbenzenesulfonamide (PubChem CID 54673209) has the molecular formula C13H12FNO2S and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-methylbenzenesulfonamide
PubChem CID54673209
Molecular FormulaC13H12FNO2S
Molecular Weight265.31 g/mol
Exact Mass265.06
IUPAC Name2-(2-fluorophenyl)-N-methylbenzenesulfonamide
SMILESCNS(=O)(=O)c1ccccc1-c1ccccc1F
InChIInChI=1S/C13H12FNO2S/c1-15-18(16,17)13-9-5-3-7-11(13)10-6-2-4-8-12(10)14/h2-9,15H,1H3
InChIKeyDAXGGHUKVIWZFW-UHFFFAOYSA-N
XLogP2.40
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-methylbenzenesulfonamide?
The IUPAC name of 2-(2-fluorophenyl)-N-methylbenzenesulfonamide (CID 54673209) is 2-(2-fluorophenyl)-N-methylbenzenesulfonamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-methylbenzenesulfonamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-methylbenzenesulfonamide is CNS(=O)(=O)c1ccccc1-c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-methylbenzenesulfonamide?
The InChIKey is DAXGGHUKVIWZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2S/c1-15-18(16,17)13-9-5-3-7-11(13)10-6-2-4-8-12(10)14/h2-9,15H,1H3.
What are the key properties of 2-(2-fluorophenyl)-N-methylbenzenesulfonamide?
2-(2-fluorophenyl)-N-methylbenzenesulfonamide has a molecular weight of 265.31 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-methylbenzenesulfonamide is sourced from PubChem (CID 54673209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).