2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide

C6H5ClF2N2O3S — CID 130072896

IUPAC2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide
SMILESNS(=O)(=O)c1c(O)cnc(Cl)c1C(F)F
InChIInChI=1S/C6H5ClF2N2O3S/c7-5-3(6(8)9)4(15(10,13)14)2(12)1-11-5/h1,6,12H,(H2,10,13,14)
InChIKeyJDNPUUFXXVIYJD-UHFFFAOYSA-N
MW258.63 g/mol
LogP1.03
Rot. Bonds2

About 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide

2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide (PubChem CID 130072896) has the molecular formula C6H5ClF2N2O3S and a molecular weight of 258.63 g/mol. Its IUPAC name is 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide.

Molecular Properties

Compound Name2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide
PubChem CID130072896
Molecular FormulaC6H5ClF2N2O3S
Molecular Weight258.63 g/mol
Exact Mass257.97
IUPAC Name2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide
SMILESNS(=O)(=O)c1c(O)cnc(Cl)c1C(F)F
InChIInChI=1S/C6H5ClF2N2O3S/c7-5-3(6(8)9)4(15(10,13)14)2(12)1-11-5/h1,6,12H,(H2,10,13,14)
InChIKeyJDNPUUFXXVIYJD-UHFFFAOYSA-N
XLogP1.03
TPSA93.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.63
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-3-(difluoromethyl)-5-methylpyridine-4-sulfonamide
CID 130074581
5-amino-2-chloro-4-(difluoromethyl)pyridine-3-sulfonamide
CID 130103132
2-chloro-5-(difluoromethyl)-3-hydroxypyridine-4-sulfonamide
CID 119007831
5-bromo-2-chloro-3-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130108482
2-bromo-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonamide
CID 118995756
6-chloro-5-(difluoromethyl)-4-fluoropyridin-3-ol
CID 118998226
3-(difluoromethyl)-5-hydroxy-2-iodopyridine-4-sulfonyl chloride
CID 130083037
2-chloro-5-(difluoromethyl)-4-methylpyridine-3-sulfonamide
CID 119010660
2-amino-5-chloro-4-(difluoromethyl)pyridine-3-sulfonamide
CID 119021143
6-chloro-4-(difluoromethyl)-5-methylpyridin-3-ol
CID 119014799
6-chloro-5-(difluoromethyl)-4-methoxypyridin-3-ol
CID 119013301
2-chloro-5-cyano-3-(difluoromethyl)pyridine-4-sulfonyl chloride
CID 130071437

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide?
The IUPAC name of 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide (CID 130072896) is 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide.
What is the SMILES notation for 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide?
The canonical SMILES for 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide is NS(=O)(=O)c1c(O)cnc(Cl)c1C(F)F.
What is the InChIKey of 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide?
The InChIKey is JDNPUUFXXVIYJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClF2N2O3S/c7-5-3(6(8)9)4(15(10,13)14)2(12)1-11-5/h1,6,12H,(H2,10,13,14).
What are the key properties of 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide?
2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide has a molecular weight of 258.63 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(difluoromethyl)-5-hydroxypyridine-4-sulfonamide is sourced from PubChem (CID 130072896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).