2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol

C13H24N2O — CID 163623801

IUPAC2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol
SMILESCN1CCC(C2=CCN(CCO)CC2)CC1
InChIInChI=1S/C13H24N2O/c1-14-6-2-12(3-7-14)13-4-8-15(9-5-13)10-11-16/h4,12,16H,2-3,5-11H2,1H3
InChIKeyHQJNICHOQUOPCX-UHFFFAOYSA-N
MW224.35 g/mol
LogP0.95
Rot. Bonds3

About 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol

2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol (PubChem CID 163623801) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol
PubChem CID163623801
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol
SMILESCN1CCC(C2=CCN(CCO)CC2)CC1
InChIInChI=1S/C13H24N2O/c1-14-6-2-12(3-7-14)13-4-8-15(9-5-13)10-11-16/h4,12,16H,2-3,5-11H2,1H3
InChIKeyHQJNICHOQUOPCX-UHFFFAOYSA-N
XLogP0.95
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-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-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The IUPAC name of 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol (CID 163623801) is 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The canonical SMILES for 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol is CN1CCC(C2=CCN(CCO)CC2)CC1.
What is the InChIKey of 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol?
The InChIKey is HQJNICHOQUOPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-14-6-2-12(3-7-14)13-4-8-15(9-5-13)10-11-16/h4,12,16H,2-3,5-11H2,1H3.
What are the key properties of 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol?
2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol has a molecular weight of 224.35 g/mol, XLogP of 0.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-methylpiperidin-4-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanol is sourced from PubChem (CID 163623801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).