TL;DR: 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane (CAS 63977-97-9) is a chemical compound with molecular formula C15H26N2O and molecular weight 250.20451 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(cyclopentylmethyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one
Also Known As: 5-23-03-00467 (Beilstein Handbook Reference), 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane, 1-[3-(cyclopentylmethyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one, 3,8-DIAZABICYCLO(3.2.1)OCTANE, 3-(CYCLOPENTYLMETHYL)-8-PROPIONYL-, 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane
| Molecular Formula | C15H26N2O |
| Molecular Weight | 250.20451 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.20451 Da |
| Heavy Atoms | 18 |
| Complexity | 298.0 |
| SMILES | CCC(=O)N1C2CCC1CN(C2)CC3CCCC3 |
| InChIKey | NZAVDKRFUVOTLS-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane. With a topological polar surface area (TPSA) of 23.6 Ų, 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane 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 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane is 63977-97-9.
The molecular formula of 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane is C15H26N2O.
The molecular weight of 3-(Cyclopentylmethyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane is 250.20451 g/mol.
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