About 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine
2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine (PubChem CID 105058733) has the molecular formula C17H18FNO
and a molecular weight of 271.33 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine.
Molecular Properties
| Compound Name | 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine |
| PubChem CID | 105058733 |
| Molecular Formula | C17H18FNO |
| Molecular Weight | 271.33 g/mol |
| Exact Mass | 271.14 |
| IUPAC Name | 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine |
| SMILES | CC1(c2ccccc2)COC(c2ccccc2F)CN1 |
| InChI | InChI=1S/C17H18FNO/c1-17(13-7-3-2-4-8-13)12-20-16(11-19-17)14-9-5-6-10-15(14)18/h2-10,16,19H,11-12H2,1H3 |
| InChIKey | LUTRILZSKCABBX-UHFFFAOYSA-N |
| XLogP | 3.40 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 271.33 |
| LogP ≤ 5 | 3.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine?
The IUPAC name of 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine (CID 105058733) is 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine.
What is the SMILES notation for 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine?
The canonical SMILES for 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine is CC1(c2ccccc2)COC(c2ccccc2F)CN1.
What is the InChIKey of 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine?
The InChIKey is LUTRILZSKCABBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c1-17(13-7-3-2-4-8-13)12-20-16(11-19-17)14-9-5-6-10-15(14)18/h2-10,16,19H,11-12H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine?
2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine has a molecular weight of 271.33 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-5-methyl-5-phenylmorpholine is sourced from PubChem (CID 105058733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).