About trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane
trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane (PubChem CID 155612623) has the molecular formula C22H25NSi
and a molecular weight of 331.54 g/mol. Its IUPAC name is trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane.
Molecular Properties
| Compound Name | trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane |
| PubChem CID | 155612623 |
| Molecular Formula | C22H25NSi |
| Molecular Weight | 331.54 g/mol |
| Exact Mass | 331.18 |
| IUPAC Name | trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane |
| SMILES | CC(c1ccccc1)c1cc(-c2ccccc2)ncc1[Si](C)(C)C |
| InChI | InChI=1S/C22H25NSi/c1-17(18-11-7-5-8-12-18)20-15-21(19-13-9-6-10-14-19)23-16-22(20)24(2,3)4/h5-17H,1-4H3 |
| InChIKey | GZDFFVNUHWMKLV-UHFFFAOYSA-N |
| XLogP | 5.45 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 331.54 |
| LogP ≤ 5 | 5.45 |
| 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 trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane?
The IUPAC name of trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane (CID 155612623) is trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane.
What is the SMILES notation for trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane?
The canonical SMILES for trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane is CC(c1ccccc1)c1cc(-c2ccccc2)ncc1[Si](C)(C)C.
What is the InChIKey of trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane?
The InChIKey is GZDFFVNUHWMKLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NSi/c1-17(18-11-7-5-8-12-18)20-15-21(19-13-9-6-10-14-19)23-16-22(20)24(2,3)4/h5-17H,1-4H3.
What are the key properties of trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane?
trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane has a molecular weight of 331.54 g/mol, XLogP of 5.45, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[6-phenyl-4-(1-phenylethyl)-3-pyridinyl]silane is sourced from PubChem (CID 155612623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).