About [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine
[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine (PubChem CID 105269294) has the molecular formula C13H15FN2O
and a molecular weight of 234.27 g/mol. Its IUPAC name is [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine |
| PubChem CID | 105269294 |
| Molecular Formula | C13H15FN2O |
| Molecular Weight | 234.27 g/mol |
| Exact Mass | 234.12 |
| IUPAC Name | [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine |
| SMILES | Cc1cc(C(NN)c2occc2C)ccc1F |
| InChI | InChI=1S/C13H15FN2O/c1-8-5-6-17-13(8)12(16-15)10-3-4-11(14)9(2)7-10/h3-7,12,16H,15H2,1-2H3 |
| InChIKey | ZJFABFZTHWTOTF-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 51.19 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 234.27 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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 [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The IUPAC name of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine (CID 105269294) is [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine is Cc1cc(C(NN)c2occc2C)ccc1F.
What is the InChIKey of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
The InChIKey is ZJFABFZTHWTOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O/c1-8-5-6-17-13(8)12(16-15)10-3-4-11(14)9(2)7-10/h3-7,12,16H,15H2,1-2H3.
What are the key properties of [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine?
[(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine has a molecular weight of 234.27 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-fluoro-3-methylphenyl)-(3-methylfuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105269294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).