5-fluoro-6-hydroxypiperidin-2-one

C5H8FNO2 — CID 141238197

IUPAC5-fluoro-6-hydroxypiperidin-2-one
SMILESO=C1CCC(F)C(O)N1
InChIInChI=1S/C5H8FNO2/c6-3-1-2-4(8)7-5(3)9/h3,5,9H,1-2H2,(H,7,8)
InChIKeyOZXOYHXTRRRBKG-UHFFFAOYSA-N
MW133.12 g/mol
LogP-0.45
Rot. Bonds

About 5-fluoro-6-hydroxypiperidin-2-one

5-fluoro-6-hydroxypiperidin-2-one (PubChem CID 141238197) has the molecular formula C5H8FNO2 and a molecular weight of 133.12 g/mol. Its IUPAC name is 5-fluoro-6-hydroxypiperidin-2-one.

Molecular Properties

Compound Name5-fluoro-6-hydroxypiperidin-2-one
PubChem CID141238197
Molecular FormulaC5H8FNO2
Molecular Weight133.12 g/mol
Exact Mass133.05
IUPAC Name5-fluoro-6-hydroxypiperidin-2-one
SMILESO=C1CCC(F)C(O)N1
InChIInChI=1S/C5H8FNO2/c6-3-1-2-4(8)7-5(3)9/h3,5,9H,1-2H2,(H,7,8)
InChIKeyOZXOYHXTRRRBKG-UHFFFAOYSA-N
XLogP-0.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.12
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-hydroxypiperidin-2-one?
The IUPAC name of 5-fluoro-6-hydroxypiperidin-2-one (CID 141238197) is 5-fluoro-6-hydroxypiperidin-2-one.
What is the SMILES notation for 5-fluoro-6-hydroxypiperidin-2-one?
The canonical SMILES for 5-fluoro-6-hydroxypiperidin-2-one is O=C1CCC(F)C(O)N1.
What is the InChIKey of 5-fluoro-6-hydroxypiperidin-2-one?
The InChIKey is OZXOYHXTRRRBKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8FNO2/c6-3-1-2-4(8)7-5(3)9/h3,5,9H,1-2H2,(H,7,8).
What are the key properties of 5-fluoro-6-hydroxypiperidin-2-one?
5-fluoro-6-hydroxypiperidin-2-one has a molecular weight of 133.12 g/mol, XLogP of -0.45, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-hydroxypiperidin-2-one is sourced from PubChem (CID 141238197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).