TL;DR: (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid (CAS 131559-49-4) is a chemical compound with molecular formula C7H13NO3 and molecular weight 159.08954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid
Also Known As: 4-methoxy-1-methylproline, (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid, (4S)-4-Methoxy-1-methyl-D-proline, D-Proline, 4-methoxy-1-methyl-, (4S)-, (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylicacid
| Molecular Formula | C7H13NO3 |
| Molecular Weight | 159.08954 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.08954 Da |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
| SMILES | CN1C[C@H](C[C@@H]1C(=O)O)OC |
| InChIKey | LCRFCICIBIZKQT-NTSWFWBYSA-N |
The XLogP value of -2.3 indicates that (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.8 Ų, (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid has 1 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 (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid is 131559-49-4.
The molecular formula of (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid is C7H13NO3.
The molecular weight of (2R,4S)-4-methoxy-1-methylpyrrolidine-2-carboxylic acid is 159.08954 g/mol.
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