6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide

C12H11FN2O3S — CID 107655560

IUPAC6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide
SMILESCc1cccc(Oc2ccc(S(N)(=O)=O)cn2)c1F
InChIInChI=1S/C12H11FN2O3S/c1-8-3-2-4-10(12(8)13)18-11-6-5-9(7-15-11)19(14,16)17/h2-7H,1H3,(H2,14,16,17)
InChIKeyUXWZYHDGLHEVDE-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.97
Rot. Bonds3

About 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide

6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide (PubChem CID 107655560) has the molecular formula C12H11FN2O3S and a molecular weight of 282.30 g/mol. Its IUPAC name is 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide
PubChem CID107655560
Molecular FormulaC12H11FN2O3S
Molecular Weight282.30 g/mol
Exact Mass282.05
IUPAC Name6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide
SMILESCc1cccc(Oc2ccc(S(N)(=O)=O)cn2)c1F
InChIInChI=1S/C12H11FN2O3S/c1-8-3-2-4-10(12(8)13)18-11-6-5-9(7-15-11)19(14,16)17/h2-7H,1H3,(H2,14,16,17)
InChIKeyUXWZYHDGLHEVDE-UHFFFAOYSA-N
XLogP1.97
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide?
The IUPAC name of 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide (CID 107655560) is 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide?
The canonical SMILES for 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide is Cc1cccc(Oc2ccc(S(N)(=O)=O)cn2)c1F.
What is the InChIKey of 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide?
The InChIKey is UXWZYHDGLHEVDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O3S/c1-8-3-2-4-10(12(8)13)18-11-6-5-9(7-15-11)19(14,16)17/h2-7H,1H3,(H2,14,16,17).
What are the key properties of 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide?
6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide has a molecular weight of 282.30 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-3-methylphenoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 107655560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).