TL;DR: 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid (CAS 1005154-13-1) is a chemical compound with molecular formula C12H21NO4 and molecular weight 243.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2,6-dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid
Also Known As: 5-(2,6-dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid, 5-(2,6-dimethylmorpholino)-3-methyl-5-oxopentanoic acid, 5-(2,6-dimethylmorpholin-4-yl)-3-methyl-5-oxo-pentanoic Acid
| Molecular Formula | C12H21NO4 |
| Molecular Weight | 243.14706 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.14706 Da |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
| SMILES | CC1CN(CC(O1)C)C(=O)CC(C)CC(=O)O |
| InChIKey | QUPIUYNKDWUNKQ-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid. Following Lipinski's Rule of Five, 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic 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 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid is 1005154-13-1.
The molecular formula of 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid is C12H21NO4.
The molecular weight of 5-(2,6-Dimethylmorpholin-4-yl)-3-methyl-5-oxopentanoic acid is 243.14706 g/mol.
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