About [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine
[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine (PubChem CID 105323985) has the molecular formula C15H26N2
and a molecular weight of 234.39 g/mol. Its IUPAC name is [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine.
Molecular Properties
| Compound Name | [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine |
| PubChem CID | 105323985 |
| Molecular Formula | C15H26N2 |
| Molecular Weight | 234.39 g/mol |
| Exact Mass | 234.21 |
| IUPAC Name | [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine |
| SMILES | CCC(CC)C(CCc1ccccc1C)NN |
| InChI | InChI=1S/C15H26N2/c1-4-13(5-2)15(17-16)11-10-14-9-7-6-8-12(14)3/h6-9,13,15,17H,4-5,10-11,16H2,1-3H3 |
| InChIKey | DBZWKTHBDBZQJD-UHFFFAOYSA-N |
| XLogP | 3.20 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 234.39 |
| LogP ≤ 5 | 3.20 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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 [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The IUPAC name of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine (CID 105323985) is [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine.
What is the SMILES notation for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The canonical SMILES for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine is CCC(CC)C(CCc1ccccc1C)NN.
What is the InChIKey of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
The InChIKey is DBZWKTHBDBZQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-13(5-2)15(17-16)11-10-14-9-7-6-8-12(14)3/h6-9,13,15,17H,4-5,10-11,16H2,1-3H3.
What are the key properties of [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine?
[4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine has a molecular weight of 234.39 g/mol, XLogP of 3.20, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(2-methylphenyl)hexan-3-yl]hydrazine is sourced from PubChem (CID 105323985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).