About [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine
[6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine (PubChem CID 114677416) has the molecular formula C11H9BrFN3O
and a molecular weight of 298.12 g/mol. Its IUPAC name is [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine.
Molecular Properties
| Compound Name | [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine |
| PubChem CID | 114677416 |
| Molecular Formula | C11H9BrFN3O |
| Molecular Weight | 298.12 g/mol |
| Exact Mass | 296.99 |
| IUPAC Name | [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine |
| SMILES | NNc1cccc(Oc2cc(Br)ccc2F)n1 |
| InChI | InChI=1S/C11H9BrFN3O/c12-7-4-5-8(13)9(6-7)17-11-3-1-2-10(15-11)16-14/h1-6H,14H2,(H,15,16) |
| InChIKey | MKAUAYRIYFUQGJ-UHFFFAOYSA-N |
| XLogP | 3.06 |
| TPSA | 60.17 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 298.12 |
| LogP ≤ 5 | 3.06 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'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 [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine?
The IUPAC name of [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine (CID 114677416) is [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine?
The canonical SMILES for [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine is NNc1cccc(Oc2cc(Br)ccc2F)n1.
What is the InChIKey of [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine?
The InChIKey is MKAUAYRIYFUQGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrFN3O/c12-7-4-5-8(13)9(6-7)17-11-3-1-2-10(15-11)16-14/h1-6H,14H2,(H,15,16).
What are the key properties of [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine?
[6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine has a molecular weight of 298.12 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine is sourced from PubChem (CID 114677416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).