4-Ethenyl-1-methylpiperidine

C8H15N — CID 10154055

IUPAC4-ethenyl-1-methylpiperidine
SMILESCN1CCC(CC1)C=C
InChIInChI=1S/C8H15N/c1-3-8-4-6-9(2)7-5-8/h3,8H,1,4-7H2,2H3
InChIKeyKNSKADMRFWMSRW-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.60
Rot. Bonds1

About 4-Ethenyl-1-methylpiperidine

4-Ethenyl-1-methylpiperidine (PubChem CID 10154055) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 4-ethenyl-1-methylpiperidine.

Molecular Properties

Compound Name4-Ethenyl-1-methylpiperidine
PubChem CID10154055
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name4-ethenyl-1-methylpiperidine
SMILESCN1CCC(CC1)C=C
InChIInChI=1S/C8H15N/c1-3-8-4-6-9(2)7-5-8/h3,8H,1,4-7H2,2H3
InChIKeyKNSKADMRFWMSRW-UHFFFAOYSA-N
XLogP1.60
TPSA3.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity90

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.60
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

1,3-Dimethyl-4-methylidenepiperidine
CID 23423756
1-Azabicyclo[3.2.2]non-2-ene
CID 13410402
1-Hex-5-enylpiperidine
CID 13839440
4-Ethenyl-1-fluoropiperidine
CID 21735060
1-(4-Fluorobutyl)-4-prop-1-en-2-ylpiperidine
CID 89140664
1-Ethyl-4-(1-fluoroethenyl)piperidine
CID 91012854
4-Ethenyl-1-ethyl-4-fluoropiperidine
CID 123282672
3-Fluoro-1-methyl-3-prop-2-enylpiperidine
CID 129044070
4-Ethenyl-1-(2-fluoroethyl)piperidine
CID 130723823
1-(2,2-Difluoroethyl)-4-ethenylpiperidine
CID 131129043
(3R,4S)-3-fluoro-1-methyl-4-prop-1-en-2-ylpiperidine
CID 143775541
4-Ethenyl-4-fluoro-1-methylpiperidine
CID 154558777

Frequently Asked Questions

What is the IUPAC name of 4-Ethenyl-1-methylpiperidine?
The IUPAC name of 4-Ethenyl-1-methylpiperidine (CID 10154055) is 4-ethenyl-1-methylpiperidine.
What is the SMILES notation for 4-Ethenyl-1-methylpiperidine?
The canonical SMILES for 4-Ethenyl-1-methylpiperidine is CN1CCC(CC1)C=C.
What is the InChIKey of 4-Ethenyl-1-methylpiperidine?
The InChIKey is KNSKADMRFWMSRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-3-8-4-6-9(2)7-5-8/h3,8H,1,4-7H2,2H3.
What are the key properties of 4-Ethenyl-1-methylpiperidine?
4-Ethenyl-1-methylpiperidine has a molecular weight of 125.21 g/mol, XLogP of 1.60, 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 is sourced from PubChem (CID 10154055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).