C16H21N3O2 — CID 105263890
[(3,5-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methyl]hydrazine (PubChem CID 105263890) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is [(3,5-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methyl]hydrazine.
| Compound Name | [(3,5-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methyl]hydrazine |
|---|---|
| PubChem CID | 105263890 |
| Molecular Formula | C16H21N3O2 |
| Molecular Weight | 287.36 g/mol |
| Exact Mass | 287.16 |
| IUPAC Name | [(3,5-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methyl]hydrazine |
| SMILES | CCc1cccnc1C(NN)c1cc(OC)cc(OC)c1 |
| InChI | InChI=1S/C16H21N3O2/c1-4-11-6-5-7-18-15(11)16(19-17)12-8-13(20-2)10-14(9-12)21-3/h5-10,16,19H,4,17H2,1-3H3 |
| InChIKey | SNCCMVHWDQFAFP-UHFFFAOYSA-N |
| XLogP | 2.21 |
| TPSA | 69.40 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 21 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 287.36 |
| LogP ≤ 5 | 2.21 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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