About N-benzyl-6-hydrazinylpyridin-3-amine
N-benzyl-6-hydrazinylpyridin-3-amine (PubChem CID 82054997) has the molecular formula C12H14N4
and a molecular weight of 214.27 g/mol. Its IUPAC name is N-benzyl-6-hydrazinylpyridin-3-amine.
Molecular Properties
| Compound Name | N-benzyl-6-hydrazinylpyridin-3-amine |
| PubChem CID | 82054997 |
| Molecular Formula | C12H14N4 |
| Molecular Weight | 214.27 g/mol |
| Exact Mass | 214.12 |
| IUPAC Name | N-benzyl-6-hydrazinylpyridin-3-amine |
| SMILES | NNc1ccc(NCc2ccccc2)cn1 |
| InChI | InChI=1S/C12H14N4/c13-16-12-7-6-11(9-15-12)14-8-10-4-2-1-3-5-10/h1-7,9,14H,8,13H2,(H,15,16) |
| InChIKey | ADFFYXCRKLGKJI-UHFFFAOYSA-N |
| XLogP | 1.98 |
| TPSA | 62.97 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.27 |
| LogP ≤ 5 | 1.98 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
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 N-benzyl-6-hydrazinylpyridin-3-amine?
The IUPAC name of N-benzyl-6-hydrazinylpyridin-3-amine (CID 82054997) is N-benzyl-6-hydrazinylpyridin-3-amine.
What is the SMILES notation for N-benzyl-6-hydrazinylpyridin-3-amine?
The canonical SMILES for N-benzyl-6-hydrazinylpyridin-3-amine is NNc1ccc(NCc2ccccc2)cn1.
What is the InChIKey of N-benzyl-6-hydrazinylpyridin-3-amine?
The InChIKey is ADFFYXCRKLGKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-16-12-7-6-11(9-15-12)14-8-10-4-2-1-3-5-10/h1-7,9,14H,8,13H2,(H,15,16).
What are the key properties of N-benzyl-6-hydrazinylpyridin-3-amine?
N-benzyl-6-hydrazinylpyridin-3-amine has a molecular weight of 214.27 g/mol, XLogP of 1.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-hydrazinylpyridin-3-amine is sourced from PubChem (CID 82054997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).