About trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane
trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane (PubChem CID 156675844) has the molecular formula C29H27NSi
and a molecular weight of 417.63 g/mol. Its IUPAC name is trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane.
Molecular Properties
| Compound Name | trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane |
| PubChem CID | 156675844 |
| Molecular Formula | C29H27NSi |
| Molecular Weight | 417.63 g/mol |
| Exact Mass | 417.19 |
| IUPAC Name | trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane |
| SMILES | Cc1cc(-c2cc(-c3ccccc3)c3cc([Si](C)(C)C)ccc3n2)cc2ccccc12 |
| InChI | InChI=1S/C29H27NSi/c1-20-16-23(17-22-12-8-9-13-25(20)22)29-19-26(21-10-6-5-7-11-21)27-18-24(31(2,3)4)14-15-28(27)30-29/h5-19H,1-4H3 |
| InChIKey | YZXGALUXVFTTNJ-UHFFFAOYSA-N |
| XLogP | 7.58 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 31 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 417.63 |
| LogP ≤ 5 | 7.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]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 trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane?
The IUPAC name of trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane (CID 156675844) is trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane.
What is the SMILES notation for trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane?
The canonical SMILES for trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane is Cc1cc(-c2cc(-c3ccccc3)c3cc([Si](C)(C)C)ccc3n2)cc2ccccc12.
What is the InChIKey of trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane?
The InChIKey is YZXGALUXVFTTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H27NSi/c1-20-16-23(17-22-12-8-9-13-25(20)22)29-19-26(21-10-6-5-7-11-21)27-18-24(31(2,3)4)14-15-28(27)30-29/h5-19H,1-4H3.
What are the key properties of trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane?
trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane has a molecular weight of 417.63 g/mol, XLogP of 7.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(4-methylnaphthalen-2-yl)-4-phenylquinolin-6-yl]silane is sourced from PubChem (CID 156675844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).