4-(1-methoxyethenyl)-1-methylpiperidine

C9H17NO — CID 58967538

IUPAC4-(1-methoxyethenyl)-1-methylpiperidine
SMILESC=C(OC)C1CCN(C)CC1
InChIInChI=1S/C9H17NO/c1-8(11-3)9-4-6-10(2)7-5-9/h9H,1,4-7H2,2-3H3
InChIKeyYWJJIEJODNQUGH-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.49
Rot. Bonds2

About 4-(1-methoxyethenyl)-1-methylpiperidine

4-(1-methoxyethenyl)-1-methylpiperidine (PubChem CID 58967538) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-(1-methoxyethenyl)-1-methylpiperidine.

Molecular Properties

Compound Name4-(1-methoxyethenyl)-1-methylpiperidine
PubChem CID58967538
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-(1-methoxyethenyl)-1-methylpiperidine
SMILESC=C(OC)C1CCN(C)CC1
InChIInChI=1S/C9H17NO/c1-8(11-3)9-4-6-10(2)7-5-9/h9H,1,4-7H2,2-3H3
InChIKeyYWJJIEJODNQUGH-UHFFFAOYSA-N
XLogP1.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.49
H-Bond Donors ≤ 50
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 4-(1-methoxyethenyl)-1-methylpiperidine?
The IUPAC name of 4-(1-methoxyethenyl)-1-methylpiperidine (CID 58967538) is 4-(1-methoxyethenyl)-1-methylpiperidine.
What is the SMILES notation for 4-(1-methoxyethenyl)-1-methylpiperidine?
The canonical SMILES for 4-(1-methoxyethenyl)-1-methylpiperidine is C=C(OC)C1CCN(C)CC1.
What is the InChIKey of 4-(1-methoxyethenyl)-1-methylpiperidine?
The InChIKey is YWJJIEJODNQUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(11-3)9-4-6-10(2)7-5-9/h9H,1,4-7H2,2-3H3.
What are the key properties of 4-(1-methoxyethenyl)-1-methylpiperidine?
4-(1-methoxyethenyl)-1-methylpiperidine has a molecular weight of 155.24 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methoxyethenyl)-1-methylpiperidine is sourced from PubChem (CID 58967538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).