TL;DR: 2-Butyl-3-methylpyrazine (CAS 15987-00-5) is a chemical compound with molecular formula C9H14N2 and molecular weight 150.11569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butyl-3-methylpyrazine
Also Known As: 2-Butyl-3-methylpyrazine, Pyrazine, 2-butyl-3-methyl-, 2-n-Butyl-3-methylpyrazine, Cisatracurium Besilete, 2-Methyl-3- butylpyrazine
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H14N2 |
| Molecular Weight | 150.11569 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.11569 Da |
| Heavy Atoms | 11 |
| Complexity | 104.0 |
| SMILES | CCCCC1=NC=CN=C1C |
| InChIKey | IRSIKJPEFMMRHD-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butyl-3-methylpyrazine. With a topological polar surface area (TPSA) of 25.8 Ų, 2-Butyl-3-methylpyrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyl-3-methylpyrazine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Butyl-3-methylpyrazine is 15987-00-5.
The molecular formula of 2-Butyl-3-methylpyrazine is C9H14N2.
The molecular weight of 2-Butyl-3-methylpyrazine is 150.11569 g/mol.
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