2-(1-Methylpiperidin-4-ylidene)ethanol

C8H15NO — CID 18695573

IUPAC2-(1-methylpiperidin-4-ylidene)ethanol
SMILESCN1CCC(=CCO)CC1
InChIInChI=1S/C8H15NO/c1-9-5-2-8(3-6-9)4-7-10/h4,10H,2-3,5-7H2,1H3
InChIKeyCIGRZYYQGRMXBI-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.00
Rot. Bonds1

About 2-(1-Methylpiperidin-4-ylidene)ethanol

2-(1-Methylpiperidin-4-ylidene)ethanol (PubChem CID 18695573) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-(1-methylpiperidin-4-ylidene)ethanol.

Molecular Properties

Compound Name2-(1-Methylpiperidin-4-ylidene)ethanol
PubChem CID18695573
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-(1-methylpiperidin-4-ylidene)ethanol
SMILESCN1CCC(=CCO)CC1
InChIInChI=1S/C8H15NO/c1-9-5-2-8(3-6-9)4-7-10/h4,10H,2-3,5-7H2,1H3
InChIKeyCIGRZYYQGRMXBI-UHFFFAOYSA-N
XLogP0.00
TPSA23.50 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity121

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(1-Methylpiperidin-4-ylidene)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-Methylpiperidin-4-ylidene)ethanol?
The IUPAC name of 2-(1-Methylpiperidin-4-ylidene)ethanol (CID 18695573) is 2-(1-methylpiperidin-4-ylidene)ethanol.
What is the SMILES notation for 2-(1-Methylpiperidin-4-ylidene)ethanol?
The canonical SMILES for 2-(1-Methylpiperidin-4-ylidene)ethanol is CN1CCC(=CCO)CC1.
What is the InChIKey of 2-(1-Methylpiperidin-4-ylidene)ethanol?
The InChIKey is CIGRZYYQGRMXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-9-5-2-8(3-6-9)4-7-10/h4,10H,2-3,5-7H2,1H3.
What are the key properties of 2-(1-Methylpiperidin-4-ylidene)ethanol?
2-(1-Methylpiperidin-4-ylidene)ethanol has a molecular weight of 141.21 g/mol, XLogP of 0.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-Methylpiperidin-4-ylidene)ethanol is sourced from PubChem (CID 18695573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).