TL;DR: Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate (CAS 1594843-48-7) is a chemical compound with molecular formula C11H16N2O3 and molecular weight 224.11609 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-amino-3-(6-methoxy-3-pyridinyl)propanoate
Also Known As: Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate
| Molecular Formula | C11H16N2O3 |
| Molecular Weight | 224.11609 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 74.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.11609 Da |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
| SMILES | CCOC(=O)CC(C1=CN=C(C=C1)OC)N |
| InChIKey | KQTCODLWVJHUAX-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate. The TPSA of 74.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate. Following Lipinski's Rule of Five, Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate is 1594843-48-7.
The molecular formula of Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate is C11H16N2O3.
The molecular weight of Ethyl 3-amino-3-(6-methoxypyridin-3-yl)propanoate is 224.11609 g/mol.
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