About 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine
1-benzyl-1-methyl-2-pyridin-3-ylhydrazine (PubChem CID 130314713) has the molecular formula C13H15N3
and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine.
Molecular Properties
| Compound Name | 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine |
| PubChem CID | 130314713 |
| Molecular Formula | C13H15N3 |
| Molecular Weight | 213.28 g/mol |
| Exact Mass | 213.13 |
| IUPAC Name | 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine |
| SMILES | CN(Cc1ccccc1)Nc1cccnc1 |
| InChI | InChI=1S/C13H15N3/c1-16(11-12-6-3-2-4-7-12)15-13-8-5-9-14-10-13/h2-10,15H,11H2,1H3 |
| InChIKey | ROALKZRXHQSDKB-UHFFFAOYSA-N |
| XLogP | 2.54 |
| TPSA | 28.16 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 213.28 |
| LogP ≤ 5 | 2.54 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine?
The IUPAC name of 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine (CID 130314713) is 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine.
What is the SMILES notation for 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine?
The canonical SMILES for 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine is CN(Cc1ccccc1)Nc1cccnc1.
What is the InChIKey of 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine?
The InChIKey is ROALKZRXHQSDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-16(11-12-6-3-2-4-7-12)15-13-8-5-9-14-10-13/h2-10,15H,11H2,1H3.
What are the key properties of 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine?
1-benzyl-1-methyl-2-pyridin-3-ylhydrazine has a molecular weight of 213.28 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-1-methyl-2-pyridin-3-ylhydrazine is sourced from PubChem (CID 130314713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).