About 2-(2-fluorophenoxy)propanehydrazide
2-(2-fluorophenoxy)propanehydrazide (PubChem CID 3865677) has the molecular formula C9H11FN2O2
and a molecular weight of 198.20 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)propanehydrazide.
Molecular Properties
| Compound Name | 2-(2-fluorophenoxy)propanehydrazide |
| PubChem CID | 3865677 |
| Molecular Formula | C9H11FN2O2 |
| Molecular Weight | 198.20 g/mol |
| Exact Mass | 198.08 |
| IUPAC Name | 2-(2-fluorophenoxy)propanehydrazide |
| SMILES | CC(Oc1ccccc1F)C(=O)NN |
| InChI | InChI=1S/C9H11FN2O2/c1-6(9(13)12-11)14-8-5-3-2-4-7(8)10/h2-6H,11H2,1H3,(H,12,13) |
| InChIKey | FEPALPYILGLEJX-UHFFFAOYSA-N |
| XLogP | 0.58 |
| TPSA | 64.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 198.20 |
| LogP ≤ 5 | 0.58 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 2-(2-fluorophenoxy)propanehydrazide?
The IUPAC name of 2-(2-fluorophenoxy)propanehydrazide (CID 3865677) is 2-(2-fluorophenoxy)propanehydrazide.
What is the SMILES notation for 2-(2-fluorophenoxy)propanehydrazide?
The canonical SMILES for 2-(2-fluorophenoxy)propanehydrazide is CC(Oc1ccccc1F)C(=O)NN.
What is the InChIKey of 2-(2-fluorophenoxy)propanehydrazide?
The InChIKey is FEPALPYILGLEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O2/c1-6(9(13)12-11)14-8-5-3-2-4-7(8)10/h2-6H,11H2,1H3,(H,12,13).
What are the key properties of 2-(2-fluorophenoxy)propanehydrazide?
2-(2-fluorophenoxy)propanehydrazide has a molecular weight of 198.20 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)propanehydrazide is sourced from PubChem (CID 3865677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).