About CID 100979280
CID 100979280 (PubChem CID 100979280) has the molecular formula C8H12NSi
and a molecular weight of 150.28 g/mol.
Molecular Properties
| Compound Name | CID 100979280 |
| PubChem CID | 100979280 |
| Molecular Formula | C8H12NSi |
| Molecular Weight | 150.28 g/mol |
| Exact Mass | 150.07 |
| IUPAC Name | — |
| SMILES | [CH2][Si](C)(C)c1ccccn1 |
| InChI | InChI=1S/C8H12NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1H2,2-3H3 |
| InChIKey | VOQQQZWXVFBCHX-UHFFFAOYSA-N |
| XLogP | 1.37 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 150.28 |
| LogP ≤ 5 | 1.37 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 CID 100979280?
The IUPAC name of CID 100979280 (CID 100979280) is not available.
What is the SMILES notation for CID 100979280?
The canonical SMILES for CID 100979280 is [CH2][Si](C)(C)c1ccccn1.
What is the InChIKey of CID 100979280?
The InChIKey is VOQQQZWXVFBCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12NSi/c1-10(2,3)8-6-4-5-7-9-8/h4-7H,1H2,2-3H3.
What are the key properties of CID 100979280?
CID 100979280 has a molecular weight of 150.28 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100979280 is sourced from PubChem (CID 100979280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).