About [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine
[(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine (PubChem CID 105269064) has the molecular formula C11H12FN3O
and a molecular weight of 221.24 g/mol. Its IUPAC name is [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine |
| PubChem CID | 105269064 |
| Molecular Formula | C11H12FN3O |
| Molecular Weight | 221.24 g/mol |
| Exact Mass | 221.10 |
| IUPAC Name | [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine |
| SMILES | Cc1occc1C(NN)c1ccncc1F |
| InChI | InChI=1S/C11H12FN3O/c1-7-8(3-5-16-7)11(15-13)9-2-4-14-6-10(9)12/h2-6,11,15H,13H2,1H3 |
| InChIKey | AOHTUPWZBFDSEZ-UHFFFAOYSA-N |
| XLogP | 1.67 |
| TPSA | 64.08 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 221.24 |
| LogP ≤ 5 | 1.67 |
| 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 [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The IUPAC name of [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine (CID 105269064) is [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The canonical SMILES for [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine is Cc1occc1C(NN)c1ccncc1F.
What is the InChIKey of [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine?
The InChIKey is AOHTUPWZBFDSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-7-8(3-5-16-7)11(15-13)9-2-4-14-6-10(9)12/h2-6,11,15H,13H2,1H3.
What are the key properties of [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine?
[(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine has a molecular weight of 221.24 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-fluoro-4-pyridinyl)-(2-methylfuran-3-yl)methyl]hydrazine is sourced from PubChem (CID 105269064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).