3,5-dimethylmorpholine;ethene

C8H17NO — CID 22465833

IUPAC3,5-dimethylmorpholine;ethene
SMILESC=C.CC1COCC(C)N1
InChIInChI=1S/C6H13NO.C2H4/c1-5-3-8-4-6(2)7-5;1-2/h5-7H,3-4H2,1-2H3;1-2H2
InChIKeyWDTSIKLZDWNUMI-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.19
Rot. Bonds

About 3,5-dimethylmorpholine;ethene

3,5-dimethylmorpholine;ethene (PubChem CID 22465833) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3,5-dimethylmorpholine;ethene.

Molecular Properties

Compound Name3,5-dimethylmorpholine;ethene
PubChem CID22465833
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3,5-dimethylmorpholine;ethene
SMILESC=C.CC1COCC(C)N1
InChIInChI=1S/C6H13NO.C2H4/c1-5-3-8-4-6(2)7-5;1-2/h5-7H,3-4H2,1-2H3;1-2H2
InChIKeyWDTSIKLZDWNUMI-UHFFFAOYSA-N
XLogP1.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
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 3,5-dimethylmorpholine;ethene?
The IUPAC name of 3,5-dimethylmorpholine;ethene (CID 22465833) is 3,5-dimethylmorpholine;ethene.
What is the SMILES notation for 3,5-dimethylmorpholine;ethene?
The canonical SMILES for 3,5-dimethylmorpholine;ethene is C=C.CC1COCC(C)N1.
What is the InChIKey of 3,5-dimethylmorpholine;ethene?
The InChIKey is WDTSIKLZDWNUMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C2H4/c1-5-3-8-4-6(2)7-5;1-2/h5-7H,3-4H2,1-2H3;1-2H2.
What are the key properties of 3,5-dimethylmorpholine;ethene?
3,5-dimethylmorpholine;ethene has a molecular weight of 143.23 g/mol, XLogP of 1.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylmorpholine;ethene is sourced from PubChem (CID 22465833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).