About 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide
2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide (PubChem CID 118911652) has the molecular formula C19H15FN2O2
and a molecular weight of 322.34 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide.
Molecular Properties
| Compound Name | 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide |
| PubChem CID | 118911652 |
| Molecular Formula | C19H15FN2O2 |
| Molecular Weight | 322.34 g/mol |
| Exact Mass | 322.11 |
| IUPAC Name | 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide |
| SMILES | O=C(Nc1cccnc1)c1ccccc1OCc1cccc(F)c1 |
| InChI | InChI=1S/C19H15FN2O2/c20-15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)19(23)22-16-7-4-10-21-12-16/h1-12H,13H2,(H,22,23) |
| InChIKey | ANAFAHZDDIMSJV-UHFFFAOYSA-N |
| XLogP | 4.05 |
| TPSA | 51.22 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 322.34 |
| LogP ≤ 5 | 4.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide (CID 118911652) is 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1ccccc1OCc1cccc(F)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
The InChIKey is ANAFAHZDDIMSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2/c20-15-6-3-5-14(11-15)13-24-18-9-2-1-8-17(18)19(23)22-16-7-4-10-21-12-16/h1-12H,13H2,(H,22,23).
What are the key properties of 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide?
2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide has a molecular weight of 322.34 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methoxy]-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 118911652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).