3,5-bis(ethenyl)morpholine

C8H13NO — CID 121376543

IUPAC3,5-bis(ethenyl)morpholine
SMILESC=CC1COCC(C=C)N1
InChIInChI=1S/C8H13NO/c1-3-7-5-10-6-8(4-2)9-7/h3-4,7-9H,1-2,5-6H2
InChIKeySHIFUTPMTZENPV-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.72
Rot. Bonds2

About 3,5-bis(ethenyl)morpholine

3,5-bis(ethenyl)morpholine (PubChem CID 121376543) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 3,5-bis(ethenyl)morpholine.

Molecular Properties

Compound Name3,5-bis(ethenyl)morpholine
PubChem CID121376543
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name3,5-bis(ethenyl)morpholine
SMILESC=CC1COCC(C=C)N1
InChIInChI=1S/C8H13NO/c1-3-7-5-10-6-8(4-2)9-7/h3-4,7-9H,1-2,5-6H2
InChIKeySHIFUTPMTZENPV-UHFFFAOYSA-N
XLogP0.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.72
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 3,5-bis(ethenyl)morpholine?
The IUPAC name of 3,5-bis(ethenyl)morpholine (CID 121376543) is 3,5-bis(ethenyl)morpholine.
What is the SMILES notation for 3,5-bis(ethenyl)morpholine?
The canonical SMILES for 3,5-bis(ethenyl)morpholine is C=CC1COCC(C=C)N1.
What is the InChIKey of 3,5-bis(ethenyl)morpholine?
The InChIKey is SHIFUTPMTZENPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-3-7-5-10-6-8(4-2)9-7/h3-4,7-9H,1-2,5-6H2.
What are the key properties of 3,5-bis(ethenyl)morpholine?
3,5-bis(ethenyl)morpholine has a molecular weight of 139.20 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(ethenyl)morpholine is sourced from PubChem (CID 121376543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).