TL;DR: 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- (CAS 114724-64-0) is a chemical compound with molecular formula C10H15N3O and molecular weight 193.1215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(1-azabicyclo[2.2.2]octan-3-yl)-3-methyl-1,2,4-oxadiazole
Also Known As: 3-Methyl-5-(quinuclidin-3-yl)-1,2,4-oxadiazole, 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)-, 3-(3-Methyl-1,2,4-oxadiazol-5-yl)quinuclidine, 3-Methyl-5-(3-quinuclidinyl)-1,2,4-oxadiazole, L-658903
| Molecular Formula | C10H15N3O |
| Molecular Weight | 193.1215 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 42.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.1215 Da |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
| SMILES | CC1=NOC(=N1)C2CN3CCC2CC3 |
| InChIKey | CJZKUTNGRZKBRH-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)-. With a topological polar surface area (TPSA) of 42.2 Ų, 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- is 114724-64-0.
The molecular formula of 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- is C10H15N3O.
The molecular weight of 1-Azabicyclo[2.2.2]octane, 3-(3-methyl-1,2,4-oxadiazol-5-yl)- is 193.1215 g/mol.
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