TL;DR: 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide (CAS 1212481-86-1) is a chemical compound with molecular formula C20H22N2O2 and molecular weight 322.16812 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide
Also Known As: 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide
| Molecular Formula | C20H22N2O2 |
| Molecular Weight | 322.16812 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.16812 Da |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
| SMILES | CC(C1=CC=CC=C1)NC(=O)C2CCC(=O)N2CC3=CC=CC=C3 |
| InChIKey | KGOFKCILZHZVDV-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide. With a topological polar surface area (TPSA) of 49.4 Ų, 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide has 1 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 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide is 1212481-86-1.
The molecular formula of 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide is C20H22N2O2.
The molecular weight of 1-benzyl-5-oxo-N-(1-phenylethyl)pyrrolidine-2-carboxamide is 322.16812 g/mol.
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