TL;DR: Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate (CAS 108824-74-4) is a chemical compound with molecular formula C9H16N2O3 and molecular weight 200.11609 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate
Also Known As: methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate, METHYL 2-(3-METHYL-2-OXO-PIPERAZIN-1-YL)PROPIONATE, Methyl 2-(3-methyl-2-oxo-piperazin-1-yl)propanoate, 1-Piperazineaceticacid, a,3-dimethyl-2-oxo-, methyl ester, 1-Piperazineaceticacid,a,3-dimethyl-2-oxo-,methyl ester
| Molecular Formula | C9H16N2O3 |
| Molecular Weight | 200.11609 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.11609 Da |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
| SMILES | CC1C(=O)N(CCN1)C(C)C(=O)OC |
| InChIKey | OLCSDNRSPAKRGN-UHFFFAOYSA-N |
The XLogP value of -0.2 indicates that Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.6 Ų, Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate 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 Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate is 108824-74-4.
The molecular formula of Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate is C9H16N2O3.
The molecular weight of Methyl 2-(3-methyl-2-oxopiperazin-1-yl)propanoate is 200.11609 g/mol.
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