About triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane
triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane (PubChem CID 161159868) has the molecular formula C30H46N2Si2
and a molecular weight of 490.88 g/mol. Its IUPAC name is triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane.
Molecular Properties
| Compound Name | triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane |
| PubChem CID | 161159868 |
| Molecular Formula | C30H46N2Si2 |
| Molecular Weight | 490.88 g/mol |
| Exact Mass | 490.32 |
| IUPAC Name | triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane |
| SMILES | CC[Si](CC)(CC)c1cc2ccccc2n1C.CC[Si](CC)(CC)c1cn(C)c2ccccc12 |
| InChI | InChI=1S/2C15H23NSi/c1-5-17(6-2,7-3)15-12-16(4)14-11-9-8-10-13(14)15;1-5-17(6-2,7-3)15-12-13-10-8-9-11-14(13)16(15)4/h2*8-12H,5-7H2,1-4H3 |
| InChIKey | UPTYCNFWDMUTOK-UHFFFAOYSA-N |
| XLogP | 7.79 |
| TPSA | 9.86 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 34 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 490.88 |
| LogP ≤ 5 | 7.79 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane?
The IUPAC name of triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane (CID 161159868) is triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane.
What is the SMILES notation for triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane?
The canonical SMILES for triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane is CC[Si](CC)(CC)c1cc2ccccc2n1C.CC[Si](CC)(CC)c1cn(C)c2ccccc12.
What is the InChIKey of triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane?
The InChIKey is UPTYCNFWDMUTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H23NSi/c1-5-17(6-2,7-3)15-12-16(4)14-11-9-8-10-13(14)15;1-5-17(6-2,7-3)15-12-13-10-8-9-11-14(13)16(15)4/h2*8-12H,5-7H2,1-4H3.
What are the key properties of triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane?
triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane has a molecular weight of 490.88 g/mol, XLogP of 7.79, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(1-methylindol-2-yl)silane;triethyl-(1-methylindol-3-yl)silane is sourced from PubChem (CID 161159868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).