About 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone (PubChem CID 110728374) has the molecular formula C18H18FNO2
and a molecular weight of 299.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone.
Molecular Properties
| Compound Name | 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone |
| PubChem CID | 110728374 |
| Molecular Formula | C18H18FNO2 |
| Molecular Weight | 299.35 g/mol |
| Exact Mass | 299.13 |
| IUPAC Name | 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone |
| SMILES | O=C(Cc1ccccc1F)N1CCOCC1c1ccccc1 |
| InChI | InChI=1S/C18H18FNO2/c19-16-9-5-4-8-15(16)12-18(21)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,17H,10-13H2 |
| InChIKey | UYLDUYBTQGPSNM-UHFFFAOYSA-N |
| XLogP | 2.97 |
| TPSA | 29.54 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 299.35 |
| LogP ≤ 5 | 2.97 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone (CID 110728374) is 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone is O=C(Cc1ccccc1F)N1CCOCC1c1ccccc1.
What is the InChIKey of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The InChIKey is UYLDUYBTQGPSNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO2/c19-16-9-5-4-8-15(16)12-18(21)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,17H,10-13H2.
What are the key properties of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone has a molecular weight of 299.35 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone is sourced from PubChem (CID 110728374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).