2-(1-prop-2-enylpiperidin-2-yl)ethanol

C10H19NO — CID 60690461

IUPAC2-(1-prop-2-enylpiperidin-2-yl)ethanol
SMILESC=CCN1CCCCC1CCO
InChIInChI=1S/C10H19NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h2,10,12H,1,3-9H2
InChIKeyOCUXHEKOSGGHKP-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds4

About 2-(1-prop-2-enylpiperidin-2-yl)ethanol

2-(1-prop-2-enylpiperidin-2-yl)ethanol (PubChem CID 60690461) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(1-prop-2-enylpiperidin-2-yl)ethanol.

Molecular Properties

Compound Name2-(1-prop-2-enylpiperidin-2-yl)ethanol
PubChem CID60690461
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-(1-prop-2-enylpiperidin-2-yl)ethanol
SMILESC=CCN1CCCCC1CCO
InChIInChI=1S/C10H19NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h2,10,12H,1,3-9H2
InChIKeyOCUXHEKOSGGHKP-UHFFFAOYSA-N
XLogP1.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-prop-2-enylpiperidin-2-yl)ethanol 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-(1-prop-2-enylpiperidin-2-yl)ethanol?
The IUPAC name of 2-(1-prop-2-enylpiperidin-2-yl)ethanol (CID 60690461) is 2-(1-prop-2-enylpiperidin-2-yl)ethanol.
What is the SMILES notation for 2-(1-prop-2-enylpiperidin-2-yl)ethanol?
The canonical SMILES for 2-(1-prop-2-enylpiperidin-2-yl)ethanol is C=CCN1CCCCC1CCO.
What is the InChIKey of 2-(1-prop-2-enylpiperidin-2-yl)ethanol?
The InChIKey is OCUXHEKOSGGHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-7-11-8-4-3-5-10(11)6-9-12/h2,10,12H,1,3-9H2.
What are the key properties of 2-(1-prop-2-enylpiperidin-2-yl)ethanol?
2-(1-prop-2-enylpiperidin-2-yl)ethanol has a molecular weight of 169.27 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-prop-2-enylpiperidin-2-yl)ethanol is sourced from PubChem (CID 60690461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).