About N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide
N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (PubChem CID 797948) has the molecular formula C14H10F2N2O3
and a molecular weight of 292.24 g/mol. Its IUPAC name is N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.
Molecular Properties
| Compound Name | N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide |
| PubChem CID | 797948 |
| Molecular Formula | C14H10F2N2O3 |
| Molecular Weight | 292.24 g/mol |
| Exact Mass | 292.07 |
| IUPAC Name | N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide |
| SMILES | O=C(Cc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1 |
| InChI | InChI=1S/C14H10F2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-11-5-6-12(16)13(8-11)18(20)21/h1-6,8H,7H2,(H,17,19) |
| InChIKey | MWEDWXZDTKDLFI-UHFFFAOYSA-N |
| XLogP | 3.05 |
| TPSA | 72.24 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 292.24 |
| LogP ≤ 5 | 3.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide (CID 797948) is N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1ccc(F)c([N+](=O)[O-])c1.
What is the InChIKey of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
The InChIKey is MWEDWXZDTKDLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O3/c15-10-3-1-9(2-4-10)7-14(19)17-11-5-6-12(16)13(8-11)18(20)21/h1-6,8H,7H2,(H,17,19).
What are the key properties of N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide?
N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide has a molecular weight of 292.24 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-nitrophenyl)-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 797948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).