About (5-benzyl-2-pyridinyl)hydrazine
(5-benzyl-2-pyridinyl)hydrazine (PubChem CID 70490189) has the molecular formula C12H13N3
and a molecular weight of 199.26 g/mol. Its IUPAC name is (5-benzyl-2-pyridinyl)hydrazine.
Molecular Properties
| Compound Name | (5-benzyl-2-pyridinyl)hydrazine |
| PubChem CID | 70490189 |
| Molecular Formula | C12H13N3 |
| Molecular Weight | 199.26 g/mol |
| Exact Mass | 199.11 |
| IUPAC Name | (5-benzyl-2-pyridinyl)hydrazine |
| SMILES | NNc1ccc(Cc2ccccc2)cn1 |
| InChI | InChI=1S/C12H13N3/c13-15-12-7-6-11(9-14-12)8-10-4-2-1-3-5-10/h1-7,9H,8,13H2,(H,14,15) |
| InChIKey | KDCBGUPANXECBS-UHFFFAOYSA-N |
| XLogP | 1.96 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.26 |
| LogP ≤ 5 | 1.96 |
| 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 (5-benzyl-2-pyridinyl)hydrazine?
The IUPAC name of (5-benzyl-2-pyridinyl)hydrazine (CID 70490189) is (5-benzyl-2-pyridinyl)hydrazine.
What is the SMILES notation for (5-benzyl-2-pyridinyl)hydrazine?
The canonical SMILES for (5-benzyl-2-pyridinyl)hydrazine is NNc1ccc(Cc2ccccc2)cn1.
What is the InChIKey of (5-benzyl-2-pyridinyl)hydrazine?
The InChIKey is KDCBGUPANXECBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-15-12-7-6-11(9-14-12)8-10-4-2-1-3-5-10/h1-7,9H,8,13H2,(H,14,15).
What are the key properties of (5-benzyl-2-pyridinyl)hydrazine?
(5-benzyl-2-pyridinyl)hydrazine has a molecular weight of 199.26 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-benzyl-2-pyridinyl)hydrazine is sourced from PubChem (CID 70490189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).