About N-(3-triethoxysilylpropyl)formamide
N-(3-triethoxysilylpropyl)formamide (PubChem CID 12612900) has the molecular formula C10H23NO4Si
and a molecular weight of 249.38 g/mol. Its IUPAC name is N-(3-triethoxysilylpropyl)formamide.
Molecular Properties
| Compound Name | N-(3-triethoxysilylpropyl)formamide |
| PubChem CID | 12612900 |
| Molecular Formula | C10H23NO4Si |
| Molecular Weight | 249.38 g/mol |
| Exact Mass | 249.14 |
| IUPAC Name | N-(3-triethoxysilylpropyl)formamide |
| SMILES | CCO[Si](CCCNC=O)(OCC)OCC |
| InChI | InChI=1S/C10H23NO4Si/c1-4-13-16(14-5-2,15-6-3)9-7-8-11-10-12/h10H,4-9H2,1-3H3,(H,11,12) |
| InChIKey | ZGJZKIWPDBYTJA-UHFFFAOYSA-N |
| XLogP | 1.17 |
| TPSA | 56.79 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 249.38 |
| LogP ≤ 5 | 1.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(3-triethoxysilylpropyl)formamide?
The IUPAC name of N-(3-triethoxysilylpropyl)formamide (CID 12612900) is N-(3-triethoxysilylpropyl)formamide.
What is the SMILES notation for N-(3-triethoxysilylpropyl)formamide?
The canonical SMILES for N-(3-triethoxysilylpropyl)formamide is CCO[Si](CCCNC=O)(OCC)OCC.
What is the InChIKey of N-(3-triethoxysilylpropyl)formamide?
The InChIKey is ZGJZKIWPDBYTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO4Si/c1-4-13-16(14-5-2,15-6-3)9-7-8-11-10-12/h10H,4-9H2,1-3H3,(H,11,12).
What are the key properties of N-(3-triethoxysilylpropyl)formamide?
N-(3-triethoxysilylpropyl)formamide has a molecular weight of 249.38 g/mol, XLogP of 1.17, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-triethoxysilylpropyl)formamide is sourced from PubChem (CID 12612900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).