About N'-(2-fluorophenyl)benzohydrazide
N'-(2-fluorophenyl)benzohydrazide (PubChem CID 2812154) has the molecular formula C13H11FN2O
and a molecular weight of 230.24 g/mol. Its IUPAC name is N'-(2-fluorophenyl)benzohydrazide.
Molecular Properties
| Compound Name | N'-(2-fluorophenyl)benzohydrazide |
| PubChem CID | 2812154 |
| Molecular Formula | C13H11FN2O |
| Molecular Weight | 230.24 g/mol |
| Exact Mass | 230.09 |
| IUPAC Name | N'-(2-fluorophenyl)benzohydrazide |
| SMILES | O=C(NNc1ccccc1F)c1ccccc1 |
| InChI | InChI=1S/C13H11FN2O/c14-11-8-4-5-9-12(11)15-16-13(17)10-6-2-1-3-7-10/h1-9,15H,(H,16,17) |
| InChIKey | MPOQIRAADPDYIU-UHFFFAOYSA-N |
| XLogP | 2.58 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.24 |
| LogP ≤ 5 | 2.58 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N'-(2-fluorophenyl)benzohydrazide?
The IUPAC name of N'-(2-fluorophenyl)benzohydrazide (CID 2812154) is N'-(2-fluorophenyl)benzohydrazide.
What is the SMILES notation for N'-(2-fluorophenyl)benzohydrazide?
The canonical SMILES for N'-(2-fluorophenyl)benzohydrazide is O=C(NNc1ccccc1F)c1ccccc1.
What is the InChIKey of N'-(2-fluorophenyl)benzohydrazide?
The InChIKey is MPOQIRAADPDYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O/c14-11-8-4-5-9-12(11)15-16-13(17)10-6-2-1-3-7-10/h1-9,15H,(H,16,17).
What are the key properties of N'-(2-fluorophenyl)benzohydrazide?
N'-(2-fluorophenyl)benzohydrazide has a molecular weight of 230.24 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorophenyl)benzohydrazide is sourced from PubChem (CID 2812154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).