TL;DR: (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid (CAS 1049984-09-9) is a chemical compound with molecular formula C11H14N2O2 and molecular weight 206.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid
Also Known As: (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid, (2S,4R)-4-(4-pyridylmethyl)proline, (2S,4R)-4-(4-pyridylmethyl)pyrrolidine-2-carboxylic acid, (2S,4R)-4-(pyridin-4-ylmethyl)-2-pyrrolidinecarboxylic acid, (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylicacid
| Molecular Formula | C11H14N2O2 |
| Molecular Weight | 206.10553 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.10553 Da |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
| SMILES | C1[C@H](CN[C@@H]1C(=O)O)CC2=CC=NC=C2 |
| InChIKey | WMOPDYHAXAWSRC-ZJUUUORDSA-N |
The XLogP value of -1.6 indicates that (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid has 2 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 (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid is 1049984-09-9.
The molecular formula of (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid is C11H14N2O2.
The molecular weight of (2S,4R)-4-(pyridin-4-ylmethyl)pyrrolidine-2-carboxylic acid is 206.10553 g/mol.
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