5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one

C6H6FNO2 — CID 152701922

IUPAC5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one
SMILESO=c1ccc(CF)c(O)[nH]1
InChIInChI=1S/C6H6FNO2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,3H2,(H2,8,9,10)
InChIKeyZRTKAFKYBUBCMB-UHFFFAOYSA-N
MW143.12 g/mol
LogP0.55
Rot. Bonds1

About 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one

5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one (PubChem CID 152701922) has the molecular formula C6H6FNO2 and a molecular weight of 143.12 g/mol. Its IUPAC name is 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one
PubChem CID152701922
Molecular FormulaC6H6FNO2
Molecular Weight143.12 g/mol
Exact Mass143.04
IUPAC Name5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one
SMILESO=c1ccc(CF)c(O)[nH]1
InChIInChI=1S/C6H6FNO2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,3H2,(H2,8,9,10)
InChIKeyZRTKAFKYBUBCMB-UHFFFAOYSA-N
XLogP0.55
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.12
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one?
The IUPAC name of 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one (CID 152701922) is 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one.
What is the SMILES notation for 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one?
The canonical SMILES for 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one is O=c1ccc(CF)c(O)[nH]1.
What is the InChIKey of 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one?
The InChIKey is ZRTKAFKYBUBCMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6FNO2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,3H2,(H2,8,9,10).
What are the key properties of 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one?
5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one has a molecular weight of 143.12 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-6-hydroxy-1H-pyridin-2-one is sourced from PubChem (CID 152701922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).