4-ethenyl-5-methoxy-2-methylpiperidine

C9H17NO — CID 14092988

IUPAC4-ethenyl-5-methoxy-2-methylpiperidine
SMILESC=CC1CC(C)NCC1OC
InChIInChI=1S/C9H17NO/c1-4-8-5-7(2)10-6-9(8)11-3/h4,7-10H,1,5-6H2,2-3H3
InChIKeyWWELSCQQXKGRLN-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.19
Rot. Bonds2

About 4-ethenyl-5-methoxy-2-methylpiperidine

4-ethenyl-5-methoxy-2-methylpiperidine (PubChem CID 14092988) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-ethenyl-5-methoxy-2-methylpiperidine.

Molecular Properties

Compound Name4-ethenyl-5-methoxy-2-methylpiperidine
PubChem CID14092988
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-ethenyl-5-methoxy-2-methylpiperidine
SMILESC=CC1CC(C)NCC1OC
InChIInChI=1S/C9H17NO/c1-4-8-5-7(2)10-6-9(8)11-3/h4,7-10H,1,5-6H2,2-3H3
InChIKeyWWELSCQQXKGRLN-UHFFFAOYSA-N
XLogP1.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-5-methoxy-2-methylpiperidine?
The IUPAC name of 4-ethenyl-5-methoxy-2-methylpiperidine (CID 14092988) is 4-ethenyl-5-methoxy-2-methylpiperidine.
What is the SMILES notation for 4-ethenyl-5-methoxy-2-methylpiperidine?
The canonical SMILES for 4-ethenyl-5-methoxy-2-methylpiperidine is C=CC1CC(C)NCC1OC.
What is the InChIKey of 4-ethenyl-5-methoxy-2-methylpiperidine?
The InChIKey is WWELSCQQXKGRLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-8-5-7(2)10-6-9(8)11-3/h4,7-10H,1,5-6H2,2-3H3.
What are the key properties of 4-ethenyl-5-methoxy-2-methylpiperidine?
4-ethenyl-5-methoxy-2-methylpiperidine has a molecular weight of 155.24 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-5-methoxy-2-methylpiperidine is sourced from PubChem (CID 14092988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).