4-ethenylpiperidine;hydrochloride

C7H14ClN — CID 54592711

IUPAC4-ethenylpiperidine;hydrochloride
SMILESC=CC1CCNCC1.Cl
InChIInChI=1S/C7H13N.ClH/c1-2-7-3-5-8-6-4-7;/h2,7-8H,1,3-6H2;1H
InChIKeyMAIWJGZFUAHGOX-UHFFFAOYSA-N
MW147.65 g/mol
LogP1.59
Rot. Bonds1

About 4-ethenylpiperidine;hydrochloride

4-ethenylpiperidine;hydrochloride (PubChem CID 54592711) has the molecular formula C7H14ClN and a molecular weight of 147.65 g/mol. Its IUPAC name is 4-ethenylpiperidine;hydrochloride.

Molecular Properties

Compound Name4-ethenylpiperidine;hydrochloride
PubChem CID54592711
Molecular FormulaC7H14ClN
Molecular Weight147.65 g/mol
Exact Mass147.08
IUPAC Name4-ethenylpiperidine;hydrochloride
SMILESC=CC1CCNCC1.Cl
InChIInChI=1S/C7H13N.ClH/c1-2-7-3-5-8-6-4-7;/h2,7-8H,1,3-6H2;1H
InChIKeyMAIWJGZFUAHGOX-UHFFFAOYSA-N
XLogP1.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.65
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 4-ethenylpiperidine;hydrochloride 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 4-ethenylpiperidine;hydrochloride?
The IUPAC name of 4-ethenylpiperidine;hydrochloride (CID 54592711) is 4-ethenylpiperidine;hydrochloride.
What is the SMILES notation for 4-ethenylpiperidine;hydrochloride?
The canonical SMILES for 4-ethenylpiperidine;hydrochloride is C=CC1CCNCC1.Cl.
What is the InChIKey of 4-ethenylpiperidine;hydrochloride?
The InChIKey is MAIWJGZFUAHGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N.ClH/c1-2-7-3-5-8-6-4-7;/h2,7-8H,1,3-6H2;1H.
What are the key properties of 4-ethenylpiperidine;hydrochloride?
4-ethenylpiperidine;hydrochloride has a molecular weight of 147.65 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenylpiperidine;hydrochloride is sourced from PubChem (CID 54592711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).