TL;DR: Pyridine, 3-ethyl-5-methyl- (CAS 3999-78-8) is a chemical compound with molecular formula C8H11N and molecular weight 121.08915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-5-methylpyridine
Also Known As: 3-ETHYL-5-METHYLPYRIDINE, Pyridine, 3-ethyl-5-methyl-, 3-ethyl-5-methyl-pyridine, 3-Picoline, 5-ethyl-, 3-Methyl-5-ethylpyridine
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H11N |
| Molecular Weight | 121.08915 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.08915 Da |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
| SMILES | CCC1=CN=CC(=C1)C |
| InChIKey | XTLUAAHBKVFNPF-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridine, 3-ethyl-5-methyl-. With a topological polar surface area (TPSA) of 12.9 Ų, Pyridine, 3-ethyl-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridine, 3-ethyl-5-methyl- has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyridine, 3-ethyl-5-methyl- is 3999-78-8.
The molecular formula of Pyridine, 3-ethyl-5-methyl- is C8H11N.
The molecular weight of Pyridine, 3-ethyl-5-methyl- is 121.08915 g/mol.
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