2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide

C7H7F3N2O3S — CID 118826041

IUPAC2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide
SMILESCOc1cnc(C(F)F)c(S(N)(=O)=O)c1F
InChIInChI=1S/C7H7F3N2O3S/c1-15-3-2-12-5(7(9)10)6(4(3)8)16(11,13)14/h2,7H,1H3,(H2,11,13,14)
InChIKeyACEIWGZQZYYJJD-UHFFFAOYSA-N
MW256.20 g/mol
LogP0.81
Rot. Bonds3

About 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide

2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide (PubChem CID 118826041) has the molecular formula C7H7F3N2O3S and a molecular weight of 256.20 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide
PubChem CID118826041
Molecular FormulaC7H7F3N2O3S
Molecular Weight256.20 g/mol
Exact Mass256.01
IUPAC Name2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide
SMILESCOc1cnc(C(F)F)c(S(N)(=O)=O)c1F
InChIInChI=1S/C7H7F3N2O3S/c1-15-3-2-12-5(7(9)10)6(4(3)8)16(11,13)14/h2,7H,1H3,(H2,11,13,14)
InChIKeyACEIWGZQZYYJJD-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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Related Compounds

2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-sulfonamide
CID 118820670
2-(difluoromethyl)-3,4-difluoro-5-methoxypyridine
CID 130099673
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-amine
CID 130103884
2-(difluoromethyl)-4-fluoro-5-methoxy-3-methylpyridine
CID 130080514
3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
CID 134670782
2-(difluoromethyl)-4-fluoro-5-methoxypyridin-3-ol
CID 130079248
[2-(difluoromethyl)-4-fluoro-5-methoxy-3-pyridinyl]methanol
CID 130080710
2-(difluoromethyl)-6-iodo-4-methoxypyridine-3-sulfonamide
CID 119008795
4-amino-2-(difluoromethyl)-5-methoxypyridine-3-carbaldehyde
CID 118829242
3-amino-2-(difluoromethyl)-5-methoxypyridine-4-carbaldehyde
CID 130106112
6-(difluoromethyl)-4-fluoro-5-methylpyridine-3-sulfonamide
CID 118854245
4-cyano-2-(difluoromethyl)-5-methylpyridine-3-sulfonamide
CID 118821692

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide?
The IUPAC name of 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide (CID 118826041) is 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide.
What is the SMILES notation for 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide?
The canonical SMILES for 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide is COc1cnc(C(F)F)c(S(N)(=O)=O)c1F.
What is the InChIKey of 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide?
The InChIKey is ACEIWGZQZYYJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O3S/c1-15-3-2-12-5(7(9)10)6(4(3)8)16(11,13)14/h2,7H,1H3,(H2,11,13,14).
What are the key properties of 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide?
2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-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 2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide is sourced from PubChem (CID 118826041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).