2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone

C8H15NO2 — CID 16769354

IUPAC2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone
SMILESCC1CCCN(C(=O)CO)C1
InChIInChI=1S/C8H15NO2/c1-7-3-2-4-9(5-7)8(11)6-10/h7,10H,2-6H2,1H3
InChIKeyOQOFOMBOFKPTHN-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.24
Rot. Bonds1

About 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone

2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone (PubChem CID 16769354) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone
PubChem CID16769354
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone
SMILESCC1CCCN(C(=O)CO)C1
InChIInChI=1S/C8H15NO2/c1-7-3-2-4-9(5-7)8(11)6-10/h7,10H,2-6H2,1H3
InChIKeyOQOFOMBOFKPTHN-UHFFFAOYSA-N
XLogP0.24
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone 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 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone (CID 16769354) is 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone is CC1CCCN(C(=O)CO)C1.
What is the InChIKey of 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone?
The InChIKey is OQOFOMBOFKPTHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7-3-2-4-9(5-7)8(11)6-10/h7,10H,2-6H2,1H3.
What are the key properties of 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone?
2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone has a molecular weight of 157.21 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(3-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 16769354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).