1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one

C13H15NO3 — CID 105492599

IUPAC1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one
SMILESO=C(CN1CCCCC1=O)c1cccc(O)c1
InChIInChI=1S/C13H15NO3/c15-11-5-3-4-10(8-11)12(16)9-14-7-2-1-6-13(14)17/h3-5,8,15H,1-2,6-7,9H2
InChIKeyBUGVOVYPLKDEEZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.59
Rot. Bonds3

About 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one

1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one (PubChem CID 105492599) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one.

Molecular Properties

Compound Name1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one
PubChem CID105492599
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one
SMILESO=C(CN1CCCCC1=O)c1cccc(O)c1
InChIInChI=1S/C13H15NO3/c15-11-5-3-4-10(8-11)12(16)9-14-7-2-1-6-13(14)17/h3-5,8,15H,1-2,6-7,9H2
InChIKeyBUGVOVYPLKDEEZ-UHFFFAOYSA-N
XLogP1.59
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one?
The IUPAC name of 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one (CID 105492599) is 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one.
What is the SMILES notation for 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one?
The canonical SMILES for 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one is O=C(CN1CCCCC1=O)c1cccc(O)c1.
What is the InChIKey of 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one?
The InChIKey is BUGVOVYPLKDEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3/c15-11-5-3-4-10(8-11)12(16)9-14-7-2-1-6-13(14)17/h3-5,8,15H,1-2,6-7,9H2.
What are the key properties of 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one?
1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one has a molecular weight of 233.27 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-hydroxyphenyl)-2-oxoethyl]piperidin-2-one is sourced from PubChem (CID 105492599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).