3-(2-methoxyethenyl)piperidine

C8H15NO — CID 143093855

IUPAC3-(2-methoxyethenyl)piperidine
SMILESCOC=CC1CCCNC1
InChIInChI=1S/C8H15NO/c1-10-6-4-8-3-2-5-9-7-8/h4,6,8-9H,2-3,5,7H2,1H3
InChIKeyZIGDACHSKXOASZ-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.15
Rot. Bonds2

About 3-(2-methoxyethenyl)piperidine

3-(2-methoxyethenyl)piperidine (PubChem CID 143093855) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3-(2-methoxyethenyl)piperidine.

Molecular Properties

Compound Name3-(2-methoxyethenyl)piperidine
PubChem CID143093855
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3-(2-methoxyethenyl)piperidine
SMILESCOC=CC1CCCNC1
InChIInChI=1S/C8H15NO/c1-10-6-4-8-3-2-5-9-7-8/h4,6,8-9H,2-3,5,7H2,1H3
InChIKeyZIGDACHSKXOASZ-UHFFFAOYSA-N
XLogP1.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethenyl)piperidine?
The IUPAC name of 3-(2-methoxyethenyl)piperidine (CID 143093855) is 3-(2-methoxyethenyl)piperidine.
What is the SMILES notation for 3-(2-methoxyethenyl)piperidine?
The canonical SMILES for 3-(2-methoxyethenyl)piperidine is COC=CC1CCCNC1.
What is the InChIKey of 3-(2-methoxyethenyl)piperidine?
The InChIKey is ZIGDACHSKXOASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-10-6-4-8-3-2-5-9-7-8/h4,6,8-9H,2-3,5,7H2,1H3.
What are the key properties of 3-(2-methoxyethenyl)piperidine?
3-(2-methoxyethenyl)piperidine has a molecular weight of 141.21 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethenyl)piperidine is sourced from PubChem (CID 143093855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).