2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone

C12H19NO2 — CID 43393285

IUPAC2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone
SMILESO=C(CC1C=CCC1)N1CCCC(O)C1
InChIInChI=1S/C12H19NO2/c14-11-6-3-7-13(9-11)12(15)8-10-4-1-2-5-10/h1,4,10-11,14H,2-3,5-9H2
InChIKeyRLDADTSKZVRMQU-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.33
Rot. Bonds2

About 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone

2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone (PubChem CID 43393285) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone
PubChem CID43393285
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone
SMILESO=C(CC1C=CCC1)N1CCCC(O)C1
InChIInChI=1S/C12H19NO2/c14-11-6-3-7-13(9-11)12(15)8-10-4-1-2-5-10/h1,4,10-11,14H,2-3,5-9H2
InChIKeyRLDADTSKZVRMQU-UHFFFAOYSA-N
XLogP1.33
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-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-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone?
The IUPAC name of 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone (CID 43393285) is 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone is O=C(CC1C=CCC1)N1CCCC(O)C1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone?
The InChIKey is RLDADTSKZVRMQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c14-11-6-3-7-13(9-11)12(15)8-10-4-1-2-5-10/h1,4,10-11,14H,2-3,5-9H2.
What are the key properties of 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone?
2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone has a molecular weight of 209.29 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-1-(3-hydroxypiperidin-1-yl)ethanone is sourced from PubChem (CID 43393285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).