About dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane
dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane (PubChem CID 158985366) has the molecular formula C32H29N3Si
and a molecular weight of 483.69 g/mol. Its IUPAC name is dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane.
Molecular Properties
| Compound Name | dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane |
| PubChem CID | 158985366 |
| Molecular Formula | C32H29N3Si |
| Molecular Weight | 483.69 g/mol |
| Exact Mass | 483.21 |
| IUPAC Name | dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane |
| SMILES | Cc1ccnc([Si](C)(C)c2cccc(-c3ccc4c5ccccc5n(-c5ncccc5C)c4c3)c2)c1 |
| InChI | InChI=1S/C32H29N3Si/c1-22-16-18-33-31(19-22)36(3,4)26-11-7-10-24(20-26)25-14-15-28-27-12-5-6-13-29(27)35(30(28)21-25)32-23(2)9-8-17-34-32/h5-21H,1-4H3 |
| InChIKey | INQVKHWSUBRYOD-UHFFFAOYSA-N |
| XLogP | 6.68 |
| TPSA | 30.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 36 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 483.69 |
| LogP ≤ 5 | 6.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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 dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane?
The IUPAC name of dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane (CID 158985366) is dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane.
What is the SMILES notation for dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane?
The canonical SMILES for dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane is Cc1ccnc([Si](C)(C)c2cccc(-c3ccc4c5ccccc5n(-c5ncccc5C)c4c3)c2)c1.
What is the InChIKey of dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane?
The InChIKey is INQVKHWSUBRYOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H29N3Si/c1-22-16-18-33-31(19-22)36(3,4)26-11-7-10-24(20-26)25-14-15-28-27-12-5-6-13-29(27)35(30(28)21-25)32-23(2)9-8-17-34-32/h5-21H,1-4H3.
What are the key properties of dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane?
dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane has a molecular weight of 483.69 g/mol, XLogP of 6.68, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(4-methyl-2-pyridinyl)-[3-[9-(3-methyl-2-pyridinyl)carbazol-2-yl]phenyl]silane is sourced from PubChem (CID 158985366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).