C13H13Cl2N3 — CID 105196072
[2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine (PubChem CID 105196072) has the molecular formula C13H13Cl2N3 and a molecular weight of 282.17 g/mol. Its IUPAC name is [2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine.
| Compound Name | [2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine |
|---|---|
| PubChem CID | 105196072 |
| Molecular Formula | C13H13Cl2N3 |
| Molecular Weight | 282.17 g/mol |
| Exact Mass | 281.05 |
| IUPAC Name | [2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine |
| SMILES | NNC(Cc1c(Cl)cccc1Cl)c1cccnc1 |
| InChI | InChI=1S/C13H13Cl2N3/c14-11-4-1-5-12(15)10(11)7-13(18-16)9-3-2-6-17-8-9/h1-6,8,13,18H,7,16H2 |
| InChIKey | MNVCIEYIATZGIV-UHFFFAOYSA-N |
| XLogP | 3.14 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 282.17 |
| LogP ≤ 5 | 3.14 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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