2-ethenyl-4-methoxy-1-methylpyrrolidine

C8H15NO — CID 164921949

IUPAC2-ethenyl-4-methoxy-1-methylpyrrolidine
SMILESC=CC1CC(OC)CN1C
InChIInChI=1S/C8H15NO/c1-4-7-5-8(10-3)6-9(7)2/h4,7-8H,1,5-6H2,2-3H3
InChIKeyGSMAVOUINZCGPF-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.89
Rot. Bonds2

About 2-ethenyl-4-methoxy-1-methylpyrrolidine

2-ethenyl-4-methoxy-1-methylpyrrolidine (PubChem CID 164921949) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-ethenyl-4-methoxy-1-methylpyrrolidine.

Molecular Properties

Compound Name2-ethenyl-4-methoxy-1-methylpyrrolidine
PubChem CID164921949
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-ethenyl-4-methoxy-1-methylpyrrolidine
SMILESC=CC1CC(OC)CN1C
InChIInChI=1S/C8H15NO/c1-4-7-5-8(10-3)6-9(7)2/h4,7-8H,1,5-6H2,2-3H3
InChIKeyGSMAVOUINZCGPF-UHFFFAOYSA-N
XLogP0.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.89
H-Bond Donors ≤ 50
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 2-ethenyl-4-methoxy-1-methylpyrrolidine?
The IUPAC name of 2-ethenyl-4-methoxy-1-methylpyrrolidine (CID 164921949) is 2-ethenyl-4-methoxy-1-methylpyrrolidine.
What is the SMILES notation for 2-ethenyl-4-methoxy-1-methylpyrrolidine?
The canonical SMILES for 2-ethenyl-4-methoxy-1-methylpyrrolidine is C=CC1CC(OC)CN1C.
What is the InChIKey of 2-ethenyl-4-methoxy-1-methylpyrrolidine?
The InChIKey is GSMAVOUINZCGPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-7-5-8(10-3)6-9(7)2/h4,7-8H,1,5-6H2,2-3H3.
What are the key properties of 2-ethenyl-4-methoxy-1-methylpyrrolidine?
2-ethenyl-4-methoxy-1-methylpyrrolidine has a molecular weight of 141.21 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-methoxy-1-methylpyrrolidine is sourced from PubChem (CID 164921949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).