About 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine
1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine (PubChem CID 145478745) has the molecular formula C10H20N2
and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine |
| PubChem CID | 145478745 |
| Molecular Formula | C10H20N2 |
| Molecular Weight | 168.28 g/mol |
| Exact Mass | 168.16 |
| IUPAC Name | 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine |
| SMILES | CCN(N)CC1CC=CC(C)C1 |
| InChI | InChI=1S/C10H20N2/c1-3-12(11)8-10-6-4-5-9(2)7-10/h4-5,9-10H,3,6-8,11H2,1-2H3 |
| InChIKey | KGSZKJSCUCLXCO-UHFFFAOYSA-N |
| XLogP | 1.78 |
| TPSA | 29.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 168.28 |
| LogP ≤ 5 | 1.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'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-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine?
The IUPAC name of 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine (CID 145478745) is 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine.
What is the SMILES notation for 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine?
The canonical SMILES for 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine is CCN(N)CC1CC=CC(C)C1.
What is the InChIKey of 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine?
The InChIKey is KGSZKJSCUCLXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-12(11)8-10-6-4-5-9(2)7-10/h4-5,9-10H,3,6-8,11H2,1-2H3.
What are the key properties of 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine?
1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine has a molecular weight of 168.28 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-[(5-methylcyclohex-3-en-1-yl)methyl]hydrazine is sourced from PubChem (CID 145478745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).