TL;DR: (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate (CAS 81755-39-7) is a chemical compound with molecular formula C14H15NO2 and molecular weight 229.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2R)-2-phenyl-2-pyrrol-1-ylacetate
Also Known As: ethyl (2S)-phenyl(1H-pyrrol-1-yl)acetate, (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate, ethyl (2R)-2-phenyl-2-pyrrol-1-ylacetate
| Molecular Formula | C14H15NO2 |
| Molecular Weight | 229.11028 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.11028 Da |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
| SMILES | CCOC(=O)[C@@H](C1=CC=CC=C1)N2C=CC=C2 |
| InChIKey | KDWUERNOAYIKFV-CYBMUJFWSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate. With a topological polar surface area (TPSA) of 31.2 Ų, (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate is 81755-39-7.
The molecular formula of (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate is C14H15NO2.
The molecular weight of (R)-Ethyl 2-phenyl-2-(1H-pyrrol-1-yl)acetate is 229.11028 g/mol.
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