3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide

C7H8F2N2O4S — CID 130083567

IUPAC3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide
SMILESCOc1cc(=O)[nH]c(S(N)(=O)=O)c1C(F)F
InChIInChI=1S/C7H8F2N2O4S/c1-15-3-2-4(12)11-7(16(10,13)14)5(3)6(8)9/h2,6H,1H3,(H,11,12)(H2,10,13,14)
InChIKeyQUMIWTFEAXPSRD-UHFFFAOYSA-N
MW254.21 g/mol
LogP-0.03
Rot. Bonds3

About 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide

3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide (PubChem CID 130083567) has the molecular formula C7H8F2N2O4S and a molecular weight of 254.21 g/mol. Its IUPAC name is 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide
PubChem CID130083567
Molecular FormulaC7H8F2N2O4S
Molecular Weight254.21 g/mol
Exact Mass254.02
IUPAC Name3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide
SMILESCOc1cc(=O)[nH]c(S(N)(=O)=O)c1C(F)F
InChIInChI=1S/C7H8F2N2O4S/c1-15-3-2-4(12)11-7(16(10,13)14)5(3)6(8)9/h2,6H,1H3,(H,11,12)(H2,10,13,14)
InChIKeyQUMIWTFEAXPSRD-UHFFFAOYSA-N
XLogP-0.03
TPSA102.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.21
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-sulfonamide
CID 118818505
6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide
CID 130074043
3-(difluoromethyl)-4-methoxy-6-nitropyridine-2-sulfonamide
CID 133087613
5-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-carbonitrile
CID 130076436
3-(difluoromethyl)-6-(hydroxymethyl)-4-methoxy-1H-pyridin-2-one
CID 130083414
6-(difluoromethyl)-5-methoxy-4-oxo-1H-pyridine-2-sulfonamide
CID 118848663
3-(difluoromethyl)-2,5-dimethoxypyridine-4-sulfonamide
CID 134670782
3-(difluoromethyl)-4-methoxy-6-(trifluoromethoxy)-1H-pyridin-2-one
CID 134658855
3-(difluoromethyl)-2-methoxy-6-oxo-1H-pyridine-4-carbonitrile
CID 130076467
5-bromo-3-(difluoromethyl)-6-oxo-1H-pyridine-2-sulfonamide
CID 130110666
6-amino-3-(difluoromethyl)-5-methoxy-1H-pyridin-2-one
CID 130104544
6-(difluoromethyl)-5-methoxy-2-methylpyridine-3-sulfonamide
CID 118826062

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide?
The IUPAC name of 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide (CID 130083567) is 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide.
What is the SMILES notation for 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide?
The canonical SMILES for 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide is COc1cc(=O)[nH]c(S(N)(=O)=O)c1C(F)F.
What is the InChIKey of 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide?
The InChIKey is QUMIWTFEAXPSRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O4S/c1-15-3-2-4(12)11-7(16(10,13)14)5(3)6(8)9/h2,6H,1H3,(H,11,12)(H2,10,13,14).
What are the key properties of 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide?
3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide has a molecular weight of 254.21 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide is sourced from PubChem (CID 130083567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).