5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one

C6H5F2NO2 — CID 130094528

IUPAC5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one
SMILESO=c1cc(O)c(C(F)F)c[nH]1
InChIInChI=1S/C6H5F2NO2/c7-6(8)3-2-9-5(11)1-4(3)10/h1-2,6H,(H2,9,10,11)
InChIKeyIPJNRXRVCVONRS-UHFFFAOYSA-N
MW161.11 g/mol
LogP1.02
Rot. Bonds1

About 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one

5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one (PubChem CID 130094528) has the molecular formula C6H5F2NO2 and a molecular weight of 161.11 g/mol. Its IUPAC name is 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one
PubChem CID130094528
Molecular FormulaC6H5F2NO2
Molecular Weight161.11 g/mol
Exact Mass161.03
IUPAC Name5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one
SMILESO=c1cc(O)c(C(F)F)c[nH]1
InChIInChI=1S/C6H5F2NO2/c7-6(8)3-2-9-5(11)1-4(3)10/h1-2,6H,(H2,9,10,11)
InChIKeyIPJNRXRVCVONRS-UHFFFAOYSA-N
XLogP1.02
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.11
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-5-methylpyridin-2(1H)-one
CID 54720146
5-(2,2,2-trifluoro-1-hydroxyethyl)-1H-pyridin-2-one
CID 10607802
2(1H)-Pyridinone, 5-methyl-4-(trifluoromethyl)-
CID 19739586
2,3-Dihydroxy-5-(trifluoromethyl)pyridine
CID 66872287
3-chloro-4-hydroxy-5-(trifluoromethyl)-1H-pyridin-2-one
CID 69330098
4-Methyl-5-(trifluoromethyl)pyridin-2-ol
CID 90095560
4-(Difluoromethyl)-5-methylpyridin-2-ol
CID 118823504
3,4-dihydroxy-5-(trifluoromethyl)-1H-pyridin-2-one
CID 144476432
2(1H)-Pyridinone, 4-(2,2,2-trifluoro-1-hydroxyethyl)-
CID 9794149
4-Fluoro-5-(hydroxymethyl)-1,2-dihydropyridin-2-one
CID 58047412
5-fluoro-6-hydroxy-2H-isoquinolin-3-one
CID 103351532
2,4-Dihydroxy-5-(trifluoromethyl)pyridine
CID 118704240

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one?
The IUPAC name of 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one (CID 130094528) is 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one.
What is the SMILES notation for 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one?
The canonical SMILES for 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one is O=c1cc(O)c(C(F)F)c[nH]1.
What is the InChIKey of 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one?
The InChIKey is IPJNRXRVCVONRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2NO2/c7-6(8)3-2-9-5(11)1-4(3)10/h1-2,6H,(H2,9,10,11).
What are the key properties of 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one?
5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one has a molecular weight of 161.11 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-4-hydroxy-1H-pyridin-2-one is sourced from PubChem (CID 130094528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).