(2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane
C12H21NO — CID 143195759
Data last refreshed: (MolForge compound catalog, from PubChem)
About (2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane
(2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane (PubChem CID 143195759) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is (2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane.
Molecular Properties
| Compound Name | (2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane |
|---|---|
| PubChem CID | 143195759 |
| Molecular Formula | C12H21NO |
| Molecular Weight | 195.31 g/mol |
| Exact Mass | 195.16 |
| IUPAC Name | (2E,3E)-3-[(Z)-but-2-enylidene]-2-ethylidenemorpholine;ethane |
| SMILES | C/C=C\C=C1\NCCO\C1=C\C.CC |
| InChI | InChI=1S/C10H15NO.C2H6/c1-3-5-6-9-10(4-2)12-8-7-11-9;1-2/h3-6,11H,7-8H2,1-2H3;1-2H3/b5-3-,9-6+,10-4+; |
| InChIKey | IXEPIZAJJOTRBR-COVVKJAWSA-N |
| XLogP | 3.00 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 195.31 |
| LogP ≤ 5 | 3.00 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Frequently Asked Questions
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Sources
- PubChem CID 143195759 — identifiers, structure, computed properties (public domain)
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