2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one

C7H8FNO2 — CID 59818284

IUPAC2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one
SMILESCn1cc(O)c(=O)cc1CF
InChIInChI=1S/C7H8FNO2/c1-9-4-7(11)6(10)2-5(9)3-8/h2,4,11H,3H2,1H3
InChIKeyPFWQZLAXJVSUHY-UHFFFAOYSA-N
MW157.14 g/mol
LogP0.56
Rot. Bonds1

About 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one

2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one (PubChem CID 59818284) has the molecular formula C7H8FNO2 and a molecular weight of 157.14 g/mol. Its IUPAC name is 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one.

Molecular Properties

Compound Name2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one
PubChem CID59818284
Molecular FormulaC7H8FNO2
Molecular Weight157.14 g/mol
Exact Mass157.05
IUPAC Name2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one
SMILESCn1cc(O)c(=O)cc1CF
InChIInChI=1S/C7H8FNO2/c1-9-4-7(11)6(10)2-5(9)3-8/h2,4,11H,3H2,1H3
InChIKeyPFWQZLAXJVSUHY-UHFFFAOYSA-N
XLogP0.56
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.14
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Deferiprone
CID 2972
CP 94
CID 86322
3-Hydroxy-2-methyl-1-propyl-4(1H)-pyridone
CID 121732
1-Ethyl-3-hydroxy-2-methyl-4-pyridinone
CID 94413
1-Allyl-2-methyl-3-hydroxypyrid-4-one
CID 3012091
5-Hydroxy-1,2-Dimethyl-4(1H)-Pyridinone
CID 12280547
2-Ethyl-3-hydroxy-1-methyl-4(1H)-pyridinone
CID 86320
3-Hydroxy-2-methyl-1-(propan-2-yl)-1,4-dihydropyridin-4-one
CID 10130140
5-Hydroxy-2-methyl-1-propan-2-ylpyridin-4-one
CID 130408003
2-Ethyl-3-hydroxy-1-propyl-4-pyridinone
CID 86321
4(1H)-Pyridinone, 2-ethyl-3-hydroxy-1-(2-propenyl)-
CID 3079582
1-Butyl-5-hydroxy-2-methylpyridin-4-one
CID 22367253

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one?
The IUPAC name of 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one (CID 59818284) is 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one.
What is the SMILES notation for 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one?
The canonical SMILES for 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one is Cn1cc(O)c(=O)cc1CF.
What is the InChIKey of 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one?
The InChIKey is PFWQZLAXJVSUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNO2/c1-9-4-7(11)6(10)2-5(9)3-8/h2,4,11H,3H2,1H3.
What are the key properties of 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one?
2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one has a molecular weight of 157.14 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-5-hydroxy-1-methylpyridin-4-one is sourced from PubChem (CID 59818284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).