About 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane
13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane (PubChem CID 134889456) has the molecular formula C14H18
and a molecular weight of 186.30 g/mol. Its IUPAC name is 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane.
Molecular Properties
| Compound Name | 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane |
| PubChem CID | 134889456 |
| Molecular Formula | C14H18 |
| Molecular Weight | 186.30 g/mol |
| Exact Mass | 186.14 |
| IUPAC Name | 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane |
| SMILES | C=C1C2(CC2)C2(CC2)C2(CC2)C12CC2 |
| InChI | InChI=1S/C14H18/c1-10-11(2-3-11)13(6-7-13)14(8-9-14)12(10)4-5-12/h1-9H2 |
| InChIKey | PXWGZRLBJYQHDK-UHFFFAOYSA-N |
| XLogP | 3.68 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.30 |
| LogP ≤ 5 | 3.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
|---|
Analyze 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane 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 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane?
The IUPAC name of 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane (CID 134889456) is 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane.
What is the SMILES notation for 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane?
The canonical SMILES for 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane is C=C1C2(CC2)C2(CC2)C2(CC2)C12CC2.
What is the InChIKey of 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane?
The InChIKey is PXWGZRLBJYQHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-10-11(2-3-11)13(6-7-13)14(8-9-14)12(10)4-5-12/h1-9H2.
What are the key properties of 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane?
13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane has a molecular weight of 186.30 g/mol, XLogP of 3.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 13-methylidenetetraspiro[2.0.24.0.27.0.210.13]tridecane is sourced from PubChem (CID 134889456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).