5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide

C18H14F2N2O2S — CID 11696183

IUPAC5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
SMILESCc1ccc(F)cc1S(=O)(=O)Nc1cccc(-c2ccccc2F)n1
InChIInChI=1S/C18H14F2N2O2S/c1-12-9-10-13(19)11-17(12)25(23,24)22-18-8-4-7-16(21-18)14-5-2-3-6-15(14)20/h2-11H,1H3,(H,21,22)
InChIKeyNPWDBFYDGHGAQM-UHFFFAOYSA-N
MW360.39 g/mol
LogP4.14
Rot. Bonds4

About 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide

5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide (PubChem CID 11696183) has the molecular formula C18H14F2N2O2S and a molecular weight of 360.39 g/mol. Its IUPAC name is 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide.

Molecular Properties

Compound Name5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
PubChem CID11696183
Molecular FormulaC18H14F2N2O2S
Molecular Weight360.39 g/mol
Exact Mass360.07
IUPAC Name5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
SMILESCc1ccc(F)cc1S(=O)(=O)Nc1cccc(-c2ccccc2F)n1
InChIInChI=1S/C18H14F2N2O2S/c1-12-9-10-13(19)11-17(12)25(23,24)22-18-8-4-7-16(21-18)14-5-2-3-6-15(14)20/h2-11H,1H3,(H,21,22)
InChIKeyNPWDBFYDGHGAQM-UHFFFAOYSA-N
XLogP4.14
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide?
The IUPAC name of 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide (CID 11696183) is 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide.
What is the SMILES notation for 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide?
The canonical SMILES for 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide is Cc1ccc(F)cc1S(=O)(=O)Nc1cccc(-c2ccccc2F)n1.
What is the InChIKey of 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide?
The InChIKey is NPWDBFYDGHGAQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N2O2S/c1-12-9-10-13(19)11-17(12)25(23,24)22-18-8-4-7-16(21-18)14-5-2-3-6-15(14)20/h2-11H,1H3,(H,21,22).
What are the key properties of 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide?
5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide has a molecular weight of 360.39 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide is sourced from PubChem (CID 11696183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).