About [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine
[5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine (PubChem CID 59457792) has the molecular formula C16H12FN5O
and a molecular weight of 309.30 g/mol. Its IUPAC name is [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine.
Molecular Properties
| Compound Name | [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine |
| PubChem CID | 59457792 |
| Molecular Formula | C16H12FN5O |
| Molecular Weight | 309.30 g/mol |
| Exact Mass | 309.10 |
| IUPAC Name | [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine |
| SMILES | NNc1ccc(-c2c(-c3ccc(F)cc3)nc3occn23)cn1 |
| InChI | InChI=1S/C16H12FN5O/c17-12-4-1-10(2-5-12)14-15(22-7-8-23-16(22)20-14)11-3-6-13(21-18)19-9-11/h1-9H,18H2,(H,19,21) |
| InChIKey | AGMYCLAGBVEXPX-UHFFFAOYSA-N |
| XLogP | 3.08 |
| TPSA | 81.38 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 309.30 |
| LogP ≤ 5 | 3.08 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 6 |
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 [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine?
The IUPAC name of [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine (CID 59457792) is [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine?
The canonical SMILES for [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine is NNc1ccc(-c2c(-c3ccc(F)cc3)nc3occn23)cn1.
What is the InChIKey of [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine?
The InChIKey is AGMYCLAGBVEXPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN5O/c17-12-4-1-10(2-5-12)14-15(22-7-8-23-16(22)20-14)11-3-6-13(21-18)19-9-11/h1-9H,18H2,(H,19,21).
What are the key properties of [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine?
[5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine has a molecular weight of 309.30 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-2-pyridinyl]hydrazine is sourced from PubChem (CID 59457792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).