6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride

C6H5ClF2N2O3S — CID 130105042

IUPAC6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride
SMILESNc1ncc(S(=O)(=O)Cl)c(C(F)F)c1O
InChIInChI=1S/C6H5ClF2N2O3S/c7-15(13,14)2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11)
InChIKeyNBFYBPIHQBNXOL-UHFFFAOYSA-N
MW258.63 g/mol
LogP1.23
Rot. Bonds2

About 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride

6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride (PubChem CID 130105042) has the molecular formula C6H5ClF2N2O3S and a molecular weight of 258.63 g/mol. Its IUPAC name is 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride.

Molecular Properties

Compound Name6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride
PubChem CID130105042
Molecular FormulaC6H5ClF2N2O3S
Molecular Weight258.63 g/mol
Exact Mass257.97
IUPAC Name6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride
SMILESNc1ncc(S(=O)(=O)Cl)c(C(F)F)c1O
InChIInChI=1S/C6H5ClF2N2O3S/c7-15(13,14)2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11)
InChIKeyNBFYBPIHQBNXOL-UHFFFAOYSA-N
XLogP1.23
TPSA93.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.63
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-4-cyano-5-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130103695
2-amino-5-bromo-4-(difluoromethyl)pyridin-3-ol
CID 130101681
6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-carbaldehyde
CID 130104859
6-amino-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119016728
5-(difluoromethyl)-4,6-difluoropyridine-3-sulfonyl chloride
CID 130099934
2-amino-4-(difluoromethyl)-5-(trifluoromethyl)pyridin-3-ol
CID 118993704
2-amino-5-bromopyridine-3-sulfonyl chloride
CID 53302026
6-(aminomethyl)-4-(difluoromethyl)-5-(trifluoromethyl)pyridine-3-sulfonyl chloride
CID 118837911
6-(difluoromethyl)-5-hydroxy-4-methoxypyridine-3-sulfonyl chloride
CID 118849103
5-chloro-4-(difluoromethyl)-6-nitropyridine-3-sulfonyl chloride
CID 131446496
6-bromo-5-(difluoromethyl)-4-fluoropyridine-3-sulfonyl chloride
CID 130109897
4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonyl chloride
CID 130074571

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride?
The IUPAC name of 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride (CID 130105042) is 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride.
What is the SMILES notation for 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride?
The canonical SMILES for 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride is Nc1ncc(S(=O)(=O)Cl)c(C(F)F)c1O.
What is the InChIKey of 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride?
The InChIKey is NBFYBPIHQBNXOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClF2N2O3S/c7-15(13,14)2-1-11-6(10)4(12)3(2)5(8)9/h1,5,12H,(H2,10,11).
What are the key properties of 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride?
6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride has a molecular weight of 258.63 g/mol, XLogP of 1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-(difluoromethyl)-5-hydroxypyridine-3-sulfonyl chloride is sourced from PubChem (CID 130105042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).