C12H14F2N4 — CID 105301848
[(3,5-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105301848) has the molecular formula C12H14F2N4 and a molecular weight of 252.27 g/mol. Its IUPAC name is [(3,5-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine.
| Compound Name | [(3,5-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine |
|---|---|
| PubChem CID | 105301848 |
| Molecular Formula | C12H14F2N4 |
| Molecular Weight | 252.27 g/mol |
| Exact Mass | 252.12 |
| IUPAC Name | [(3,5-difluorophenyl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine |
| SMILES | Cc1c(C(NN)c2cc(F)cc(F)c2)cnn1C |
| InChI | InChI=1S/C12H14F2N4/c1-7-11(6-16-18(7)2)12(17-15)8-3-9(13)5-10(14)4-8/h3-6,12,17H,15H2,1-2H3 |
| InChIKey | DWXWIYBKOHHEMH-UHFFFAOYSA-N |
| XLogP | 1.56 |
| TPSA | 55.87 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 252.27 |
| LogP ≤ 5 | 1.56 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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