About [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine
[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (PubChem CID 105258723) has the molecular formula C14H11F2N3O
and a molecular weight of 275.26 g/mol. Its IUPAC name is [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine |
| PubChem CID | 105258723 |
| Molecular Formula | C14H11F2N3O |
| Molecular Weight | 275.26 g/mol |
| Exact Mass | 275.09 |
| IUPAC Name | [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine |
| SMILES | NNC(c1cc2cccc(F)c2o1)c1ccncc1F |
| InChI | InChI=1S/C14H11F2N3O/c15-10-3-1-2-8-6-12(20-14(8)10)13(19-17)9-4-5-18-7-11(9)16/h1-7,13,19H,17H2 |
| InChIKey | PIKSBMYUUBCRKB-UHFFFAOYSA-N |
| XLogP | 2.66 |
| TPSA | 64.08 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 275.26 |
| LogP ≤ 5 | 2.66 |
| 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 [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The IUPAC name of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine (CID 105258723) is [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is NNC(c1cc2cccc(F)c2o1)c1ccncc1F.
What is the InChIKey of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
The InChIKey is PIKSBMYUUBCRKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3O/c15-10-3-1-2-8-6-12(20-14(8)10)13(19-17)9-4-5-18-7-11(9)16/h1-7,13,19H,17H2.
What are the key properties of [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine?
[(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine has a molecular weight of 275.26 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-fluoro-1-benzofuran-2-yl)-(3-fluoro-4-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105258723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).