About 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine
5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine (PubChem CID 66922255) has the molecular formula C11H16N2Si
and a molecular weight of 204.35 g/mol. Its IUPAC name is 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine.
Molecular Properties
| Compound Name | 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine |
| PubChem CID | 66922255 |
| Molecular Formula | C11H16N2Si |
| Molecular Weight | 204.35 g/mol |
| Exact Mass | 204.11 |
| IUPAC Name | 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine |
| SMILES | Cc1cncc(NC#C[Si](C)(C)C)c1 |
| InChI | InChI=1S/C11H16N2Si/c1-10-7-11(9-12-8-10)13-5-6-14(2,3)4/h7-9,13H,1-4H3 |
| InChIKey | VGGMAVJANOHZCQ-UHFFFAOYSA-N |
| XLogP | 2.64 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.35 |
| LogP ≤ 5 | 2.64 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine?
The IUPAC name of 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine (CID 66922255) is 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine?
The canonical SMILES for 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine is Cc1cncc(NC#C[Si](C)(C)C)c1.
What is the InChIKey of 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine?
The InChIKey is VGGMAVJANOHZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2Si/c1-10-7-11(9-12-8-10)13-5-6-14(2,3)4/h7-9,13H,1-4H3.
What are the key properties of 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine?
5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine has a molecular weight of 204.35 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-trimethylsilylethynyl)pyridin-3-amine is sourced from PubChem (CID 66922255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).