4-ethenyl-1-methylpiperidine;hydrochloride

C8H16ClN — CID 173358659

IUPAC4-ethenyl-1-methylpiperidine;hydrochloride
SMILESC=CC1CCN(C)CC1.Cl
InChIInChI=1S/C8H15N.ClH/c1-3-8-4-6-9(2)7-5-8;/h3,8H,1,4-7H2,2H3;1H
InChIKeyPXOCJRVPFZAXLK-UHFFFAOYSA-N
MW161.68 g/mol
LogP1.94
Rot. Bonds1

About 4-ethenyl-1-methylpiperidine;hydrochloride

4-ethenyl-1-methylpiperidine;hydrochloride (PubChem CID 173358659) has the molecular formula C8H16ClN and a molecular weight of 161.68 g/mol. Its IUPAC name is 4-ethenyl-1-methylpiperidine;hydrochloride.

Molecular Properties

Compound Name4-ethenyl-1-methylpiperidine;hydrochloride
PubChem CID173358659
Molecular FormulaC8H16ClN
Molecular Weight161.68 g/mol
Exact Mass161.10
IUPAC Name4-ethenyl-1-methylpiperidine;hydrochloride
SMILESC=CC1CCN(C)CC1.Cl
InChIInChI=1S/C8H15N.ClH/c1-3-8-4-6-9(2)7-5-8;/h3,8H,1,4-7H2,2H3;1H
InChIKeyPXOCJRVPFZAXLK-UHFFFAOYSA-N
XLogP1.94
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.68
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-ethenyl-1-methylpiperidine;molecular hydrogen
CID 143787743
(3S)-3-ethenyl-1-methylpyrrolidine
CID 134577901
4-ethenyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine
CID 170617106
4-ethenyl-1-ethylpiperidine;hydrobromide
CID 175127367
1-methylpiperidine-4-carbaldehyde;hydrobromide
CID 175478635
1-ethenyl-4-prop-1-en-2-ylcyclohexane;1-methyl-4-(1-methylpiperidin-4-yl)piperazine
CID 176683518
4-ethenyl-1-(2-methylpropyl)piperidine
CID 138457613
1-methylazepane-4-carbaldehyde
CID 82418035
1-methylpiperidin-4-ol;trihydrochloride
CID 142686130
2-(4-ethenylpiperidin-1-yl)acetic acid;hydrochloride
CID 131134631
1-methyl-4-[(3E)-penta-1,3-dien-3-yl]piperidine
CID 142926355
1-methylpyrrolidine-3-carbaldehyde
CID 19841633

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-methylpiperidine;hydrochloride?
The IUPAC name of 4-ethenyl-1-methylpiperidine;hydrochloride (CID 173358659) is 4-ethenyl-1-methylpiperidine;hydrochloride.
What is the SMILES notation for 4-ethenyl-1-methylpiperidine;hydrochloride?
The canonical SMILES for 4-ethenyl-1-methylpiperidine;hydrochloride is C=CC1CCN(C)CC1.Cl.
What is the InChIKey of 4-ethenyl-1-methylpiperidine;hydrochloride?
The InChIKey is PXOCJRVPFZAXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N.ClH/c1-3-8-4-6-9(2)7-5-8;/h3,8H,1,4-7H2,2H3;1H.
What are the key properties of 4-ethenyl-1-methylpiperidine;hydrochloride?
4-ethenyl-1-methylpiperidine;hydrochloride has a molecular weight of 161.68 g/mol, XLogP of 1.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-methylpiperidine;hydrochloride is sourced from PubChem (CID 173358659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).