About (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine
(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine (PubChem CID 144959959) has the molecular formula C9H12FNO
and a molecular weight of 169.20 g/mol. Its IUPAC name is (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine.
Molecular Properties
| Compound Name | (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine |
| PubChem CID | 144959959 |
| Molecular Formula | C9H12FNO |
| Molecular Weight | 169.20 g/mol |
| Exact Mass | 169.09 |
| IUPAC Name | (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine |
| SMILES | C=C(C)/C(F)=C1/NCCOC1=C |
| InChI | InChI=1S/C9H12FNO/c1-6(2)8(10)9-7(3)12-5-4-11-9/h11H,1,3-5H2,2H3/b9-8- |
| InChIKey | BDSAIAYYPOLTHV-HJWRWDBZSA-N |
| XLogP | 1.88 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 169.20 |
| LogP ≤ 5 | 1.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The IUPAC name of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine (CID 144959959) is (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine.
What is the SMILES notation for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The canonical SMILES for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine is C=C(C)/C(F)=C1/NCCOC1=C.
What is the InChIKey of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
The InChIKey is BDSAIAYYPOLTHV-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H12FNO/c1-6(2)8(10)9-7(3)12-5-4-11-9/h11H,1,3-5H2,2H3/b9-8-.
What are the key properties of (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine?
(3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine has a molecular weight of 169.20 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-(1-fluoro-2-methylprop-2-enylidene)-2-methylidenemorpholine is sourced from PubChem (CID 144959959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).