TL;DR: 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one (CAS 1216840-29-7) is a chemical compound with molecular formula C11H19NO2 and molecular weight 197.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-methoxyethyl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b]pyridin-4-one
Also Known As: ZERO/004883, 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one, 1-(2-methoxyethyl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b]pyridin-4-one, 1-(2-methoxyethyl)octahydro-4H-cyclopenta[b]pyridin-4-one hydrochloride, 5-(2-methoxyethyl)-5-azabicyclo[4.3.0]nonan-2-one
| Molecular Formula | C11H19NO2 |
| Molecular Weight | 197.14159 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.14159 Da |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
| SMILES | COCCN1CCC(=O)C2C1CCC2 |
| InChIKey | IUOLYOXUZNUQQK-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one. With a topological polar surface area (TPSA) of 29.5 Ų, 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one is 1216840-29-7.
The molecular formula of 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one is C11H19NO2.
The molecular weight of 1-(2-Methoxyethyl)-octahydro-1H-cyclopenta[b]pyridin-4-one is 197.14159 g/mol.
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