6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid

C7H4F3NO3 — CID 130079649

IUPAC6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid
SMILESO=C(O)c1cc(C(F)F)nc(F)c1O
InChIInChI=1S/C7H4F3NO3/c8-5(9)3-1-2(7(13)14)4(12)6(10)11-3/h1,5,12H,(H,13,14)
InChIKeyNFNIQGDCPIUIKZ-UHFFFAOYSA-N
MW207.11 g/mol
LogP1.56
Rot. Bonds2

About 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid

6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid (PubChem CID 130079649) has the molecular formula C7H4F3NO3 and a molecular weight of 207.11 g/mol. Its IUPAC name is 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid
PubChem CID130079649
Molecular FormulaC7H4F3NO3
Molecular Weight207.11 g/mol
Exact Mass207.01
IUPAC Name6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid
SMILESO=C(O)c1cc(C(F)F)nc(F)c1O
InChIInChI=1S/C7H4F3NO3/c8-5(9)3-1-2(7(13)14)4(12)6(10)11-3/h1,5,12H,(H,13,14)
InChIKeyNFNIQGDCPIUIKZ-UHFFFAOYSA-N
XLogP1.56
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.11
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-(difluoromethyl)-2-fluoro-3-(trifluoromethyl)pyridine-4-carboxylic acid
CID 133103752
2,3-dichloro-6-(difluoromethyl)pyridine-4-carboxylic acid
CID 119009190
2-(difluoromethyl)-5-fluoropyridine-4-carboxylic acid
CID 118809173
2-chloro-6-(difluoromethyl)-3-iodopyridine-4-carboxylic acid
CID 119024451
6-(difluoromethyl)-2-iodo-3-methylpyridine-4-carboxylic acid
CID 130086233
6-(difluoromethyl)-2,3-dimethoxypyridine-4-carboxylic acid
CID 130100962
6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-carboxylic acid
CID 130087967
4-(chloromethyl)-6-(difluoromethyl)-2-fluoropyridin-3-ol
CID 130079502
6-(difluoromethyl)-2-fluoro-4-methoxypyridin-3-ol
CID 130079256
2-chloro-6-(difluoromethyl)-3-methoxypyridine-4-carboxylic acid
CID 119002941
2-bromo-6-(difluoromethyl)-3-methoxypyridine-4-carboxylic acid
CID 119013170
6-(difluoromethyl)-2-fluoro-3-methoxypyridine-4-carbonyl chloride
CID 133105714

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid?
The IUPAC name of 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid (CID 130079649) is 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid.
What is the SMILES notation for 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid?
The canonical SMILES for 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid is O=C(O)c1cc(C(F)F)nc(F)c1O.
What is the InChIKey of 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid?
The InChIKey is NFNIQGDCPIUIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F3NO3/c8-5(9)3-1-2(7(13)14)4(12)6(10)11-3/h1,5,12H,(H,13,14).
What are the key properties of 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid?
6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid has a molecular weight of 207.11 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-2-fluoro-3-hydroxypyridine-4-carboxylic acid is sourced from PubChem (CID 130079649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).