6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide

C7H7F3N2O3S — CID 133105136

IUPAC6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide
SMILESCOc1nc(C(F)F)cc(S(N)(=O)=O)c1F
InChIInChI=1S/C7H7F3N2O3S/c1-15-7-5(8)4(16(11,13)14)2-3(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyGEJPFSUAXFGUDD-UHFFFAOYSA-N
MW256.20 g/mol
LogP0.81
Rot. Bonds3

About 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide

6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide (PubChem CID 133105136) has the molecular formula C7H7F3N2O3S and a molecular weight of 256.20 g/mol. Its IUPAC name is 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide.

Molecular Properties

Compound Name6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide
PubChem CID133105136
Molecular FormulaC7H7F3N2O3S
Molecular Weight256.20 g/mol
Exact Mass256.01
IUPAC Name6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide
SMILESCOc1nc(C(F)F)cc(S(N)(=O)=O)c1F
InChIInChI=1S/C7H7F3N2O3S/c1-15-7-5(8)4(16(11,13)14)2-3(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyGEJPFSUAXFGUDD-UHFFFAOYSA-N
XLogP0.81
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.20
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide?
The IUPAC name of 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide (CID 133105136) is 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide.
What is the SMILES notation for 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide?
The canonical SMILES for 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide is COc1nc(C(F)F)cc(S(N)(=O)=O)c1F.
What is the InChIKey of 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide?
The InChIKey is GEJPFSUAXFGUDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O3S/c1-15-7-5(8)4(16(11,13)14)2-3(12-7)6(9)10/h2,6H,1H3,(H2,11,13,14).
What are the key properties of 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide?
6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide has a molecular weight of 256.20 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-3-fluoro-2-methoxypyridine-4-sulfonamide is sourced from PubChem (CID 133105136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).