About trimethoxy(3-piperazin-1-ylpropyl)silane
trimethoxy(3-piperazin-1-ylpropyl)silane (PubChem CID 12841680) has the molecular formula C10H24N2O3Si
and a molecular weight of 248.40 g/mol. Its IUPAC name is trimethoxy(3-piperazin-1-ylpropyl)silane.
Molecular Properties
| Compound Name | trimethoxy(3-piperazin-1-ylpropyl)silane |
| PubChem CID | 12841680 |
| Molecular Formula | C10H24N2O3Si |
| Molecular Weight | 248.40 g/mol |
| Exact Mass | 248.16 |
| IUPAC Name | trimethoxy(3-piperazin-1-ylpropyl)silane |
| SMILES | CO[Si](CCCN1CCNCC1)(OC)OC |
| InChI | InChI=1S/C10H24N2O3Si/c1-13-16(14-2,15-3)10-4-7-12-8-5-11-6-9-12/h11H,4-10H2,1-3H3 |
| InChIKey | HXYMWKLNCJPAKW-UHFFFAOYSA-N |
| XLogP | 0.16 |
| TPSA | 42.96 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 248.40 |
| LogP ≤ 5 | 0.16 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze trimethoxy(3-piperazin-1-ylpropyl)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 trimethoxy(3-piperazin-1-ylpropyl)silane?
The IUPAC name of trimethoxy(3-piperazin-1-ylpropyl)silane (CID 12841680) is trimethoxy(3-piperazin-1-ylpropyl)silane.
What is the SMILES notation for trimethoxy(3-piperazin-1-ylpropyl)silane?
The canonical SMILES for trimethoxy(3-piperazin-1-ylpropyl)silane is CO[Si](CCCN1CCNCC1)(OC)OC.
What is the InChIKey of trimethoxy(3-piperazin-1-ylpropyl)silane?
The InChIKey is HXYMWKLNCJPAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3Si/c1-13-16(14-2,15-3)10-4-7-12-8-5-11-6-9-12/h11H,4-10H2,1-3H3.
What are the key properties of trimethoxy(3-piperazin-1-ylpropyl)silane?
trimethoxy(3-piperazin-1-ylpropyl)silane has a molecular weight of 248.40 g/mol, XLogP of 0.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy(3-piperazin-1-ylpropyl)silane is sourced from PubChem (CID 12841680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).