About trimethoxy(1-pyridin-4-ylethyl)silane
trimethoxy(1-pyridin-4-ylethyl)silane (PubChem CID 66657112) has the molecular formula C10H17NO3Si
and a molecular weight of 227.34 g/mol. Its IUPAC name is trimethoxy(1-pyridin-4-ylethyl)silane.
Molecular Properties
| Compound Name | trimethoxy(1-pyridin-4-ylethyl)silane |
| PubChem CID | 66657112 |
| Molecular Formula | C10H17NO3Si |
| Molecular Weight | 227.34 g/mol |
| Exact Mass | 227.10 |
| IUPAC Name | trimethoxy(1-pyridin-4-ylethyl)silane |
| SMILES | CO[Si](OC)(OC)C(C)c1ccncc1 |
| InChI | InChI=1S/C10H17NO3Si/c1-9(10-5-7-11-8-6-10)15(12-2,13-3)14-4/h5-9H,1-4H3 |
| InChIKey | NELAPBHCQJOJCX-UHFFFAOYSA-N |
| XLogP | 1.60 |
| TPSA | 40.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.34 |
| LogP ≤ 5 | 1.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethoxy(1-pyridin-4-ylethyl)silane?
The IUPAC name of trimethoxy(1-pyridin-4-ylethyl)silane (CID 66657112) is trimethoxy(1-pyridin-4-ylethyl)silane.
What is the SMILES notation for trimethoxy(1-pyridin-4-ylethyl)silane?
The canonical SMILES for trimethoxy(1-pyridin-4-ylethyl)silane is CO[Si](OC)(OC)C(C)c1ccncc1.
What is the InChIKey of trimethoxy(1-pyridin-4-ylethyl)silane?
The InChIKey is NELAPBHCQJOJCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO3Si/c1-9(10-5-7-11-8-6-10)15(12-2,13-3)14-4/h5-9H,1-4H3.
What are the key properties of trimethoxy(1-pyridin-4-ylethyl)silane?
trimethoxy(1-pyridin-4-ylethyl)silane has a molecular weight of 227.34 g/mol, XLogP of 1.60, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(1-pyridin-4-ylethyl)silane is sourced from PubChem (CID 66657112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).