About 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide (PubChem CID 38765188) has the molecular formula C15H13F2NO2
and a molecular weight of 277.27 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide.
Molecular Properties
| Compound Name | 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide |
| PubChem CID | 38765188 |
| Molecular Formula | C15H13F2NO2 |
| Molecular Weight | 277.27 g/mol |
| Exact Mass | 277.09 |
| IUPAC Name | 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide |
| SMILES | O=C(CCOc1ccc(F)cc1)Nc1ccccc1F |
| InChI | InChI=1S/C15H13F2NO2/c16-11-5-7-12(8-6-11)20-10-9-15(19)18-14-4-2-1-3-13(14)17/h1-8H,9-10H2,(H,18,19) |
| InChIKey | YSDQYEQIFGHONW-UHFFFAOYSA-N |
| XLogP | 3.37 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.27 |
| LogP ≤ 5 | 3.37 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide?
The IUPAC name of 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide (CID 38765188) is 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide.
What is the SMILES notation for 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide?
The canonical SMILES for 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide is O=C(CCOc1ccc(F)cc1)Nc1ccccc1F.
What is the InChIKey of 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide?
The InChIKey is YSDQYEQIFGHONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c16-11-5-7-12(8-6-11)20-10-9-15(19)18-14-4-2-1-3-13(14)17/h1-8H,9-10H2,(H,18,19).
What are the key properties of 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide?
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide has a molecular weight of 277.27 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide is sourced from PubChem (CID 38765188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).