CAS 7499-19-6 | 2-Methyl-3-phenylpropanamide (also referred to as 2-methyl-2-phenylpropionamide) is a primary amide building block featuring a benzylic stereogenic center adjacent to the amide functionality. This compound is a versatile intermediate in medicinal chemistry, particularly in the synthesis of CNS-active agents, antiviral compounds, and Rho kinase inhibitors. Its combination of a hydrophobic phenyl ring with a polar amide group makes it ideal for fragment-based drug design and lead optimization campaigns.
Product Specifications
| CAS Number | 7499-19-6 |
| Molecular Formula | C₁₀H₁₃NO |
| Molecular Weight | 163.22 g/mol |
| MDL Number | MFCD00185702 |
| InChI Key | NEDLYQXZCPTKOD-UHFFFAOYSA-N |
| Melting Point | 106 °C |
| Boiling Point | 340.5 ± 21.0 °C (Predicted) |
| Density | 1.043 ± 0.06 g/cm³ (Predicted) |
| LogP | 1.6 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| HS Code | 2924299090 |
Applications
- Key intermediate for pharmaceutical intermediates and fine chemical synthesis
- Building block in the preparation of GlyT2 inhibitors for CNS disorders (muscle spasticity, tinnitus, epilepsy, neuropathic pain)
- Used in the synthesis of antiviral agents targeting HIV (WO2012065062A1, WO2013006792A1)
- Precursor for Rho kinase inhibitors in pulmonary disease treatment (asthma, COPD, IPF, PAH)
- Substrate for palladium-catalyzed hydroaminocarbonylation reactions
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