About diethoxy-ethyliodanuidyl-(methoxymethyl)silane
diethoxy-ethyliodanuidyl-(methoxymethyl)silane (PubChem CID 161206412) has the molecular formula C8H20IO3Si-
and a molecular weight of 319.24 g/mol. Its IUPAC name is diethoxy-ethyliodanuidyl-(methoxymethyl)silane.
Molecular Properties
| Compound Name | diethoxy-ethyliodanuidyl-(methoxymethyl)silane |
| PubChem CID | 161206412 |
| Molecular Formula | C8H20IO3Si- |
| Molecular Weight | 319.24 g/mol |
| Exact Mass | 319.02 |
| IUPAC Name | diethoxy-ethyliodanuidyl-(methoxymethyl)silane |
| SMILES | CCO[Si](COC)(OCC)[I-]CC |
| InChI | InChI=1S/C8H20IO3Si/c1-5-9-13(8-10-4,11-6-2)12-7-3/h5-8H2,1-4H3/q-1 |
| InChIKey | ZTJDGDRTDWNGLA-UHFFFAOYSA-N |
| XLogP | -1.71 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 319.24 |
| LogP ≤ 5 | -1.71 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
|---|
Analyze diethoxy-ethyliodanuidyl-(methoxymethyl)silane 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 diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The IUPAC name of diethoxy-ethyliodanuidyl-(methoxymethyl)silane (CID 161206412) is diethoxy-ethyliodanuidyl-(methoxymethyl)silane.
What is the SMILES notation for diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The canonical SMILES for diethoxy-ethyliodanuidyl-(methoxymethyl)silane is CCO[Si](COC)(OCC)[I-]CC.
What is the InChIKey of diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
The InChIKey is ZTJDGDRTDWNGLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20IO3Si/c1-5-9-13(8-10-4,11-6-2)12-7-3/h5-8H2,1-4H3/q-1.
What are the key properties of diethoxy-ethyliodanuidyl-(methoxymethyl)silane?
diethoxy-ethyliodanuidyl-(methoxymethyl)silane has a molecular weight of 319.24 g/mol, XLogP of -1.71, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-ethyliodanuidyl-(methoxymethyl)silane is sourced from PubChem (CID 161206412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).