About 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide (PubChem CID 7700855) has the molecular formula C15H13F2NO2
and a molecular weight of 277.27 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide.
Molecular Properties
| Compound Name | 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide |
| PubChem CID | 7700855 |
| Molecular Formula | C15H13F2NO2 |
| Molecular Weight | 277.27 g/mol |
| Exact Mass | 277.09 |
| IUPAC Name | 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide |
| SMILES | O=C(COc1ccccc1F)NCc1ccc(F)cc1 |
| InChI | InChI=1S/C15H13F2NO2/c16-12-7-5-11(6-8-12)9-18-15(19)10-20-14-4-2-1-3-13(14)17/h1-8H,9-10H2,(H,18,19) |
| InChIKey | SODKRWPJBNLGKW-UHFFFAOYSA-N |
| XLogP | 2.66 |
| 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 | 2.66 |
| 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-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide (CID 7700855) is 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide is O=C(COc1ccccc1F)NCc1ccc(F)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide?
The InChIKey is SODKRWPJBNLGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NO2/c16-12-7-5-11(6-8-12)9-18-15(19)10-20-14-4-2-1-3-13(14)17/h1-8H,9-10H2,(H,18,19).
What are the key properties of 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide?
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide has a molecular weight of 277.27 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 7700855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).