4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one

C12H14FNO2 — CID 126669020

IUPAC4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one
SMILESCN1C(=O)CC(c2ccc(F)cc2)CC1O
InChIInChI=1S/C12H14FNO2/c1-14-11(15)6-9(7-12(14)16)8-2-4-10(13)5-3-8/h2-5,9,11,15H,6-7H2,1H3
InChIKeyYXGDWXTWXMKGIJ-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.48
Rot. Bonds1

About 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one

4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one (PubChem CID 126669020) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one
PubChem CID126669020
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC Name4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one
SMILESCN1C(=O)CC(c2ccc(F)cc2)CC1O
InChIInChI=1S/C12H14FNO2/c1-14-11(15)6-9(7-12(14)16)8-2-4-10(13)5-3-8/h2-5,9,11,15H,6-7H2,1H3
InChIKeyYXGDWXTWXMKGIJ-UHFFFAOYSA-N
XLogP1.48
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one?
The IUPAC name of 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one (CID 126669020) is 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one.
What is the SMILES notation for 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one?
The canonical SMILES for 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one is CN1C(=O)CC(c2ccc(F)cc2)CC1O.
What is the InChIKey of 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one?
The InChIKey is YXGDWXTWXMKGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-14-11(15)6-9(7-12(14)16)8-2-4-10(13)5-3-8/h2-5,9,11,15H,6-7H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one?
4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one has a molecular weight of 223.25 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-6-hydroxy-1-methylpiperidin-2-one is sourced from PubChem (CID 126669020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).