About methyl-tri(pyrazol-1-yl)silane
methyl-tri(pyrazol-1-yl)silane (PubChem CID 100955402) has the molecular formula C10H12N6Si
and a molecular weight of 244.33 g/mol. Its IUPAC name is methyl-tri(pyrazol-1-yl)silane.
Molecular Properties
| Compound Name | methyl-tri(pyrazol-1-yl)silane |
| PubChem CID | 100955402 |
| Molecular Formula | C10H12N6Si |
| Molecular Weight | 244.33 g/mol |
| Exact Mass | 244.09 |
| IUPAC Name | methyl-tri(pyrazol-1-yl)silane |
| SMILES | C[Si](n1cccn1)(n1cccn1)n1cccn1 |
| InChI | InChI=1S/C10H12N6Si/c1-17(14-8-2-5-11-14,15-9-3-6-12-15)16-10-4-7-13-16/h2-10H,1H3 |
| InChIKey | SKKDGUXJMKCQAK-UHFFFAOYSA-N |
| XLogP | 0.79 |
| TPSA | 53.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 244.33 |
| LogP ≤ 5 | 0.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
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 methyl-tri(pyrazol-1-yl)silane?
The IUPAC name of methyl-tri(pyrazol-1-yl)silane (CID 100955402) is methyl-tri(pyrazol-1-yl)silane.
What is the SMILES notation for methyl-tri(pyrazol-1-yl)silane?
The canonical SMILES for methyl-tri(pyrazol-1-yl)silane is C[Si](n1cccn1)(n1cccn1)n1cccn1.
What is the InChIKey of methyl-tri(pyrazol-1-yl)silane?
The InChIKey is SKKDGUXJMKCQAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6Si/c1-17(14-8-2-5-11-14,15-9-3-6-12-15)16-10-4-7-13-16/h2-10H,1H3.
What are the key properties of methyl-tri(pyrazol-1-yl)silane?
methyl-tri(pyrazol-1-yl)silane has a molecular weight of 244.33 g/mol, XLogP of 0.79, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-tri(pyrazol-1-yl)silane is sourced from PubChem (CID 100955402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).