3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide

C8H10F2N2O4S — CID 134670782

IUPAC3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
SMILESCOc1cnc(OC)c(C(F)F)c1S(N)(=O)=O
InChIInChI=1S/C8H10F2N2O4S/c1-15-4-3-12-8(16-2)5(7(9)10)6(4)17(11,13)14/h3,7H,1-2H3,(H2,11,13,14)
InChIKeyRXUQVTGQYVZCHB-UHFFFAOYSA-N
MW268.24 g/mol
LogP0.68
Rot. Bonds4

About 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide

3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide (PubChem CID 134670782) has the molecular formula C8H10F2N2O4S and a molecular weight of 268.24 g/mol. Its IUPAC name is 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide.

Molecular Properties

Compound Name3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
PubChem CID134670782
Molecular FormulaC8H10F2N2O4S
Molecular Weight268.24 g/mol
Exact Mass268.03
IUPAC Name3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
SMILESCOc1cnc(OC)c(C(F)F)c1S(N)(=O)=O
InChIInChI=1S/C8H10F2N2O4S/c1-15-4-3-12-8(16-2)5(7(9)10)6(4)17(11,13)14/h3,7H,1-2H3,(H2,11,13,14)
InChIKeyRXUQVTGQYVZCHB-UHFFFAOYSA-N
XLogP0.68
TPSA91.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.24
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(difluoromethyl)-2,5-dimethoxypyridin-4-amine
CID 130100785
3-(difluoromethyl)-2-methoxy-5-methylpyridine-4-sulfonyl chloride
CID 130088007
2-(difluoromethyl)-4-fluoro-5-methoxypyridine-3-sulfonamide
CID 118826041
3-bromo-4-(difluoromethyl)-2,5-dimethoxypyridine
CID 130100804
4-(chloromethyl)-3-(difluoromethyl)-2,5-dimethoxypyridine
CID 130100950
methyl 4-(difluoromethyl)-2,5-dimethoxypyridine-3-carboxylate
CID 134684678
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridin-4-amine
CID 118800001
4-bromo-5-(difluoromethyl)-6-methoxypyridine-3-sulfonyl chloride
CID 118828945
3-(difluoromethyl)-5-methoxy-2-(trifluoromethoxy)pyridine-4-carbaldehyde
CID 134677184
4-amino-5-(difluoromethyl)-6-methoxypyridine-3-carbaldehyde
CID 118817700
2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-sulfonamide
CID 118820670
4-bromo-6-(difluoromethyl)-2-methoxypyridine-3-sulfonamide
CID 118850937

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide?
The IUPAC name of 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide (CID 134670782) is 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide.
What is the SMILES notation for 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide?
The canonical SMILES for 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide is COc1cnc(OC)c(C(F)F)c1S(N)(=O)=O.
What is the InChIKey of 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide?
The InChIKey is RXUQVTGQYVZCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O4S/c1-15-4-3-12-8(16-2)5(7(9)10)6(4)17(11,13)14/h3,7H,1-2H3,(H2,11,13,14).
What are the key properties of 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide?
3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide has a molecular weight of 268.24 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide is sourced from PubChem (CID 134670782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).