About 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine
1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine (PubChem CID 107012511) has the molecular formula C18H36N2
and a molecular weight of 280.50 g/mol. Its IUPAC name is 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine.
Molecular Properties
| Compound Name | 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine |
| PubChem CID | 107012511 |
| Molecular Formula | C18H36N2 |
| Molecular Weight | 280.50 g/mol |
| Exact Mass | 280.29 |
| IUPAC Name | 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine |
| SMILES | C=CCCCCCC(NN)C1CCC(C(C)(C)C)CC1 |
| InChI | InChI=1S/C18H36N2/c1-5-6-7-8-9-10-17(20-19)15-11-13-16(14-12-15)18(2,3)4/h5,15-17,20H,1,6-14,19H2,2-4H3 |
| InChIKey | DCSFYPNZXRYLTP-UHFFFAOYSA-N |
| XLogP | 4.81 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.50 |
| LogP ≤ 5 | 4.81 |
| 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': 'isolated_alkene', '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 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine?
The IUPAC name of 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine (CID 107012511) is 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine?
The canonical SMILES for 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine is C=CCCCCCC(NN)C1CCC(C(C)(C)C)CC1.
What is the InChIKey of 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine?
The InChIKey is DCSFYPNZXRYLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-5-6-7-8-9-10-17(20-19)15-11-13-16(14-12-15)18(2,3)4/h5,15-17,20H,1,6-14,19H2,2-4H3.
What are the key properties of 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine?
1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine has a molecular weight of 280.50 g/mol, XLogP of 4.81, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylcyclohexyl)oct-7-enylhydrazine is sourced from PubChem (CID 107012511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).