2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol

C13H23NO — CID 56789997

IUPAC2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol
SMILESOCCC1CCCN(C2C=CCCC2)C1
InChIInChI=1S/C13H23NO/c15-10-8-12-5-4-9-14(11-12)13-6-2-1-3-7-13/h2,6,12-13,15H,1,3-5,7-11H2
InChIKeySSPBMNXIYBHLLL-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.19
Rot. Bonds3

About 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol

2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol (PubChem CID 56789997) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol
PubChem CID56789997
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol
SMILESOCCC1CCCN(C2C=CCCC2)C1
InChIInChI=1S/C13H23NO/c15-10-8-12-5-4-9-14(11-12)13-6-2-1-3-7-13/h2,6,12-13,15H,1,3-5,7-11H2
InChIKeySSPBMNXIYBHLLL-UHFFFAOYSA-N
XLogP2.19
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-cyclohex-2-en-1-ylpiperidin-3-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

Related Compounds

CID 2845911
CID 2845911
CID 126770405
CID 126770405
CID 124291655
CID 124291655
CID 124291656
CID 124291656
CID 124291657
CID 124291657
CID 124291658
CID 124291658
CID 22120929
CID 22120929
CID 67859558
CID 67859558
CID 68199887
CID 68199887
CID 68199935
CID 68199935
CID 68213096
CID 68213096
CID 68213287
CID 68213287

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol?
The IUPAC name of 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol (CID 56789997) is 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol.
What is the SMILES notation for 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol?
The canonical SMILES for 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol is OCCC1CCCN(C2C=CCCC2)C1.
What is the InChIKey of 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol?
The InChIKey is SSPBMNXIYBHLLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c15-10-8-12-5-4-9-14(11-12)13-6-2-1-3-7-13/h2,6,12-13,15H,1,3-5,7-11H2.
What are the key properties of 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol?
2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol has a molecular weight of 209.33 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohex-2-en-1-ylpiperidin-3-yl)ethanol is sourced from PubChem (CID 56789997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).