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

C6H4F4N2O2S — CID 118840960

IUPAC3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ncc(F)c(F)c1C(F)F
InChIInChI=1S/C6H4F4N2O2S/c7-2-1-12-6(15(11,13)14)3(4(2)8)5(9)10/h1,5H,(H2,11,13,14)
InChIKeyHEKCHUVFCSXGDQ-UHFFFAOYSA-N
MW244.17 g/mol
LogP0.94
Rot. Bonds2

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

3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide (PubChem CID 118840960) has the molecular formula C6H4F4N2O2S and a molecular weight of 244.17 g/mol. Its IUPAC name is 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide.

Molecular Properties

Compound Name3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide
PubChem CID118840960
Molecular FormulaC6H4F4N2O2S
Molecular Weight244.17 g/mol
Exact Mass243.99
IUPAC Name3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide
SMILESNS(=O)(=O)c1ncc(F)c(F)c1C(F)F
InChIInChI=1S/C6H4F4N2O2S/c7-2-1-12-6(15(11,13)14)3(4(2)8)5(9)10/h1,5H,(H2,11,13,14)
InChIKeyHEKCHUVFCSXGDQ-UHFFFAOYSA-N
XLogP0.94
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.17
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-3-(difluoromethyl)-5-fluoropyridine-2-sulfonamide
CID 118810599
5-chloro-3-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134674493
5-bromo-4-(difluoromethyl)-3-fluoropyridine-2-sulfonamide
CID 130109962
3-(difluoromethyl)-4-fluoro-5-nitropyridine-2-sulfonamide
CID 133104372
4-amino-3-(difluoromethyl)pyridine-2-sulfonamide
CID 118829041
3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
CID 118807178
3-(difluoromethyl)-4-fluoro-6-methoxypyridine-2-sulfonamide
CID 133105151
4-(difluoromethyl)-5-hydroxy-3-nitropyridine-2-sulfonamide
CID 118801115
3-(difluoromethyl)-4-methoxy-5-nitropyridine-2-sulfonamide
CID 133087554
5-(difluoromethyl)-3-hydroxypyridine-2-sulfonamide
CID 130097291
5-chloro-4-(difluoromethyl)-3-nitropyridine-2-sulfonamide
CID 134685598
5-chloro-4-(difluoromethyl)-3-fluoropyridine-2-sulfonyl chloride
CID 130072158

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide?
The IUPAC name of 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide (CID 118840960) is 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide.
What is the SMILES notation for 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide?
The canonical SMILES for 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide is NS(=O)(=O)c1ncc(F)c(F)c1C(F)F.
What is the InChIKey of 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide?
The InChIKey is HEKCHUVFCSXGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F4N2O2S/c7-2-1-12-6(15(11,13)14)3(4(2)8)5(9)10/h1,5H,(H2,11,13,14).
What are the key properties of 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide?
3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide has a molecular weight of 244.17 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-4,5-difluoropyridine-2-sulfonamide is sourced from PubChem (CID 118840960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).