5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide

C7H5F2N3O3S — CID 130077089

IUPAC5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
SMILESN#Cc1c[nH]c(=O)c(C(F)F)c1S(N)(=O)=O
InChIInChI=1S/C7H5F2N3O3S/c8-6(9)4-5(16(11,14)15)3(1-10)2-12-7(4)13/h2,6H,(H,12,13)(H2,11,14,15)
InChIKeySSQHHCKRAZADKJ-UHFFFAOYSA-N
MW249.20 g/mol
LogP-0.17
Rot. Bonds2

About 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide

5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide (PubChem CID 130077089) has the molecular formula C7H5F2N3O3S and a molecular weight of 249.20 g/mol. Its IUPAC name is 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide.

Molecular Properties

Compound Name5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
PubChem CID130077089
Molecular FormulaC7H5F2N3O3S
Molecular Weight249.20 g/mol
Exact Mass249.00
IUPAC Name5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
SMILESN#Cc1c[nH]c(=O)c(C(F)F)c1S(N)(=O)=O
InChIInChI=1S/C7H5F2N3O3S/c8-6(9)4-5(16(11,14)15)3(1-10)2-12-7(4)13/h2,6H,(H,12,13)(H2,11,14,15)
InChIKeySSQHHCKRAZADKJ-UHFFFAOYSA-N
XLogP-0.17
TPSA116.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide
CID 130110670
4-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-sulfonamide
CID 118851891
5-cyano-4-(difluoromethyl)-2-fluoropyridine-3-sulfonamide
CID 134669756
5-(difluoromethyl)-4-oxo-6-(trifluoromethyl)-1H-pyridine-3-carbonitrile
CID 130076719
6-(difluoromethyl)-5-iodo-4-oxo-1H-pyridine-3-carbonitrile
CID 130076424
5-(cyanomethyl)-3-(difluoromethyl)-2-oxo-1H-pyridine-4-carbonitrile
CID 118822034
6-cyano-5-(difluoromethyl)-4-oxo-1H-pyridine-2-sulfonamide
CID 119002683
6-chloro-4-cyano-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130071480
4-(difluoromethyl)-5-nitro-2-oxo-1H-pyridine-3-carbonitrile
CID 130076538
2-(difluoromethyl)-5-hydroxy-4-oxo-1H-pyridine-3-sulfonamide
CID 130100388
5-cyano-2-(difluoromethyl)-3-hydroxypyridine-4-sulfonamide
CID 130077095
2-[4-(difluoromethyl)-5-hydroxy-2-oxo-1H-pyridin-3-yl]acetonitrile
CID 118852469

Frequently Asked Questions

What is the IUPAC name of 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide?
The IUPAC name of 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide (CID 130077089) is 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide.
What is the SMILES notation for 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide?
The canonical SMILES for 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide is N#Cc1c[nH]c(=O)c(C(F)F)c1S(N)(=O)=O.
What is the InChIKey of 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide?
The InChIKey is SSQHHCKRAZADKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2N3O3S/c8-6(9)4-5(16(11,14)15)3(1-10)2-12-7(4)13/h2,6H,(H,12,13)(H2,11,14,15).
What are the key properties of 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide?
5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide has a molecular weight of 249.20 g/mol, XLogP of -0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-3-(difluoromethyl)-2-oxo-1H-pyridine-4-sulfonamide is sourced from PubChem (CID 130077089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).