About [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine
[1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine (PubChem CID 105277264) has the molecular formula C15H32N2O3S
and a molecular weight of 320.50 g/mol. Its IUPAC name is [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine.
Molecular Properties
| Compound Name | [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine |
| PubChem CID | 105277264 |
| Molecular Formula | C15H32N2O3S |
| Molecular Weight | 320.50 g/mol |
| Exact Mass | 320.21 |
| IUPAC Name | [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine |
| SMILES | CCOC1(C(CCCS(=O)(=O)CC)NN)CCC(C)CC1 |
| InChI | InChI=1S/C15H32N2O3S/c1-4-20-15(10-8-13(3)9-11-15)14(17-16)7-6-12-21(18,19)5-2/h13-14,17H,4-12,16H2,1-3H3 |
| InChIKey | YWINSHXLWFYQCC-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 81.42 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 320.50 |
| LogP ≤ 5 | 2.02 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine?
The IUPAC name of [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine (CID 105277264) is [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine.
What is the SMILES notation for [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine?
The canonical SMILES for [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine is CCOC1(C(CCCS(=O)(=O)CC)NN)CCC(C)CC1.
What is the InChIKey of [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine?
The InChIKey is YWINSHXLWFYQCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O3S/c1-4-20-15(10-8-13(3)9-11-15)14(17-16)7-6-12-21(18,19)5-2/h13-14,17H,4-12,16H2,1-3H3.
What are the key properties of [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine?
[1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine has a molecular weight of 320.50 g/mol, XLogP of 2.02, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-ethoxy-4-methylcyclohexyl)-4-ethylsulfonylbutyl]hydrazine is sourced from PubChem (CID 105277264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).