3-ethenyl-2-ethylmorpholine

C8H15NO — CID 123930146

IUPAC3-ethenyl-2-ethylmorpholine
SMILESC=CC1NCCOC1CC
InChIInChI=1S/C8H15NO/c1-3-7-8(4-2)10-6-5-9-7/h3,7-9H,1,4-6H2,2H3
InChIKeyKOEGLSDVBOUVES-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.94
Rot. Bonds2

About 3-ethenyl-2-ethylmorpholine

3-ethenyl-2-ethylmorpholine (PubChem CID 123930146) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3-ethenyl-2-ethylmorpholine.

Molecular Properties

Compound Name3-ethenyl-2-ethylmorpholine
PubChem CID123930146
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3-ethenyl-2-ethylmorpholine
SMILESC=CC1NCCOC1CC
InChIInChI=1S/C8H15NO/c1-3-7-8(4-2)10-6-5-9-7/h3,7-9H,1,4-6H2,2H3
InChIKeyKOEGLSDVBOUVES-UHFFFAOYSA-N
XLogP0.94
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 ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-ethenyl-2-ethylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2-ethylmorpholine?
The IUPAC name of 3-ethenyl-2-ethylmorpholine (CID 123930146) is 3-ethenyl-2-ethylmorpholine.
What is the SMILES notation for 3-ethenyl-2-ethylmorpholine?
The canonical SMILES for 3-ethenyl-2-ethylmorpholine is C=CC1NCCOC1CC.
What is the InChIKey of 3-ethenyl-2-ethylmorpholine?
The InChIKey is KOEGLSDVBOUVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-7-8(4-2)10-6-5-9-7/h3,7-9H,1,4-6H2,2H3.
What are the key properties of 3-ethenyl-2-ethylmorpholine?
3-ethenyl-2-ethylmorpholine has a molecular weight of 141.21 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2-ethylmorpholine is sourced from PubChem (CID 123930146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).