About N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide
N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide (PubChem CID 16651045) has the molecular formula C20H16FNO2
and a molecular weight of 321.35 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide.
Molecular Properties
| Compound Name | N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide |
| PubChem CID | 16651045 |
| Molecular Formula | C20H16FNO2 |
| Molecular Weight | 321.35 g/mol |
| Exact Mass | 321.12 |
| IUPAC Name | N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide |
| SMILES | Cc1ccc(Oc2ccc(C(=O)Nc3ccc(F)cc3)cc2)cc1 |
| InChI | InChI=1S/C20H16FNO2/c1-14-2-10-18(11-3-14)24-19-12-4-15(5-13-19)20(23)22-17-8-6-16(21)7-9-17/h2-13H,1H3,(H,22,23) |
| InChIKey | WGENXBFWJFBMHN-UHFFFAOYSA-N |
| XLogP | 5.18 |
| TPSA | 38.33 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 321.35 |
| LogP ≤ 5 | 5.18 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide?
The IUPAC name of N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide (CID 16651045) is N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide?
The canonical SMILES for N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide is Cc1ccc(Oc2ccc(C(=O)Nc3ccc(F)cc3)cc2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide?
The InChIKey is WGENXBFWJFBMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO2/c1-14-2-10-18(11-3-14)24-19-12-4-15(5-13-19)20(23)22-17-8-6-16(21)7-9-17/h2-13H,1H3,(H,22,23).
What are the key properties of N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide?
N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide has a molecular weight of 321.35 g/mol, XLogP of 5.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide is sourced from PubChem (CID 16651045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).