TL;DR: 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- (CAS 136410-28-1) 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.
1-benzyl-5-propoxypyrrolidin-2-one
Also Known As: 1-benzyl-5-propoxypyrrolidin-2-one, (+-)-1-(Phenylmethyl)-5-propoxy-2-pyrrolidinone, 5-Propoxy-1-[benzyl]pyrrolidin-2-one, 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)-, 1-benzyl-2-oxo-5-n-propyloxy-pyrrolidine
| Molecular Formula | C14H19NO2 |
| Molecular Weight | 233.14159 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 233.14159 Da |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
| SMILES | CCCOC1CCC(=O)N1CC2=CC=CC=C2 |
| InChIKey | VDSUSCVJIQVSRE-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)-. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- 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 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- is 136410-28-1.
The molecular formula of 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- is C14H19NO2.
The molecular weight of 2-Pyrrolidinone, 1-(phenylmethyl)-5-propoxy-, (+-)- is 233.14159 g/mol.
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