About octan-2-ylhydrazine
octan-2-ylhydrazine (PubChem CID 20811) has the molecular formula C8H20N2
and a molecular weight of 144.26 g/mol. Its IUPAC name is octan-2-ylhydrazine.
Molecular Properties
| Compound Name | octan-2-ylhydrazine |
| PubChem CID | 20811 |
| Molecular Formula | C8H20N2 |
| Molecular Weight | 144.26 g/mol |
| Exact Mass | 144.16 |
| IUPAC Name | octan-2-ylhydrazine |
| SMILES | CCCCCCC(C)NN |
| InChI | InChI=1S/C8H20N2/c1-3-4-5-6-7-8(2)10-9/h8,10H,3-7,9H2,1-2H3 |
| InChIKey | FODQIVGFADUBKE-UHFFFAOYSA-N |
| XLogP | 1.81 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 144.26 |
| LogP ≤ 5 | 1.81 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 octan-2-ylhydrazine?
The IUPAC name of octan-2-ylhydrazine (CID 20811) is octan-2-ylhydrazine.
What is the SMILES notation for octan-2-ylhydrazine?
The canonical SMILES for octan-2-ylhydrazine is CCCCCCC(C)NN.
What is the InChIKey of octan-2-ylhydrazine?
The InChIKey is FODQIVGFADUBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2/c1-3-4-5-6-7-8(2)10-9/h8,10H,3-7,9H2,1-2H3.
What are the key properties of octan-2-ylhydrazine?
octan-2-ylhydrazine has a molecular weight of 144.26 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for octan-2-ylhydrazine is sourced from PubChem (CID 20811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).