TL;DR: Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- (CAS 134937-61-4) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-ylethanone
Also Known As: Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)-, 1-((2,5-Dimethylphenoxy)acetyl)pyrrolidine, BAS 04877761, 1-[(2,5-dimethylphenoxy)acetyl]pyrrolidine, 2-(2,5-dimethylphenoxy)-1-pyrrolidin-1-ylethanone
| Molecular Formula | C14H19NO2 |
| Molecular Weight | 233.14159 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.14159 Da |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
| SMILES | CC1=CC(=C(C=C1)C)OCC(=O)N2CCCC2 |
| InChIKey | ITRSVSRDFLFYTN-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)-. With a topological polar surface area (TPSA) of 29.5 Ų, Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- 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 Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- is 134937-61-4.
The molecular formula of Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- is C14H19NO2.
The molecular weight of Pyrrolidine, 1-((2,5-dimethylphenoxy)acetyl)- is 233.14159 g/mol.
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