TL;DR: rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid (CAS 1443148-29-5) is a chemical compound with molecular formula C8H13NO2 and molecular weight 155.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3aR,6aR)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3a-carboxylic acid
Also Known As: Rac-(3ar,6ar)-octahydrocyclopenta[c]pyrrole-3a-carboxylic acid, rel-(3aR,6aR)-Hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxylic acid, (3aR,6aR)-Hexahydrocyclopenta[c]pyrrole-3a(1H)-carboxylic acid, (3aR,6aR)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-3a-carboxylic acid, (3aR,6aR)-Hexahydro-cyclopenta[c]pyrrole-3a-carboxylic acid
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.09464 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.09464 Da |
| Heavy Atoms | 11 |
| Complexity | 193.0 |
| SMILES | C1C[C@H]2CNC[C@]2(C1)C(=O)O |
| InChIKey | JTTVKCQDFDFKRG-XPUUQOCRSA-N |
The XLogP value of -2.1 indicates that rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid has 2 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 rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid is 1443148-29-5.
The molecular formula of rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid is C8H13NO2.
The molecular weight of rac-(3aR,6aR)-octahydrocyclopenta(c)pyrrole-3a-carboxylic acid is 155.09464 g/mol.
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