TL;DR: Methyl 2-amino-2-(naphthalen-1-yl)acetate (CAS 100393-37-1) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-amino-2-naphthalen-1-ylacetate
Also Known As: methyl 2-amino-2-(naphthalen-1-yl)acetate, methyl amino(naphthalen-1-yl)acetate, 2-(1-Naphthyl)glycine methyl ester, methyl 2-amino-2-naphthalen-1-ylacetate, Methyl 2-amino-2-naphthalen-1-yl-acetate
| Molecular Formula | C13H13NO2 |
| Molecular Weight | 215.09464 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.09464 Da |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
| SMILES | COC(=O)C(C1=CC=CC2=CC=CC=C21)N |
| InChIKey | LTASPYVMQCESLM-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-amino-2-(naphthalen-1-yl)acetate. With a topological polar surface area (TPSA) of 52.3 Ų, Methyl 2-amino-2-(naphthalen-1-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-amino-2-(naphthalen-1-yl)acetate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methyl 2-amino-2-(naphthalen-1-yl)acetate is 100393-37-1.
The molecular formula of Methyl 2-amino-2-(naphthalen-1-yl)acetate is C13H13NO2.
The molecular weight of Methyl 2-amino-2-(naphthalen-1-yl)acetate is 215.09464 g/mol.
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