About 6-ethyl-2-methyldec-5-ene
6-ethyl-2-methyldec-5-ene (PubChem CID 123276587) has the molecular formula C13H26
and a molecular weight of 182.35 g/mol. Its IUPAC name is 6-ethyl-2-methyldec-5-ene.
Molecular Properties
| Compound Name | 6-ethyl-2-methyldec-5-ene |
| PubChem CID | 123276587 |
| Molecular Formula | C13H26 |
| Molecular Weight | 182.35 g/mol |
| Exact Mass | 182.20 |
| IUPAC Name | 6-ethyl-2-methyldec-5-ene |
| SMILES | CCCCC(=CCCC(C)C)CC |
| InChI | InChI=1S/C13H26/c1-5-7-10-13(6-2)11-8-9-12(3)4/h11-12H,5-10H2,1-4H3 |
| InChIKey | STKCBNOFNMXHSF-UHFFFAOYSA-N |
| XLogP | 4.95 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 7 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.35 |
| LogP ≤ 5 | 4.95 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
Analyze 6-ethyl-2-methyldec-5-ene 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 6-ethyl-2-methyldec-5-ene?
The IUPAC name of 6-ethyl-2-methyldec-5-ene (CID 123276587) is 6-ethyl-2-methyldec-5-ene.
What is the SMILES notation for 6-ethyl-2-methyldec-5-ene?
The canonical SMILES for 6-ethyl-2-methyldec-5-ene is CCCCC(=CCCC(C)C)CC.
What is the InChIKey of 6-ethyl-2-methyldec-5-ene?
The InChIKey is STKCBNOFNMXHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26/c1-5-7-10-13(6-2)11-8-9-12(3)4/h11-12H,5-10H2,1-4H3.
What are the key properties of 6-ethyl-2-methyldec-5-ene?
6-ethyl-2-methyldec-5-ene has a molecular weight of 182.35 g/mol, XLogP of 4.95, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyldec-5-ene is sourced from PubChem (CID 123276587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).