TL;DR: 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- (CAS 136410-44-1) is a chemical compound with molecular formula C20H31NO2 and molecular weight 317.23547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-5-nonoxypyrrolidin-2-one
Also Known As: 1-benzyl-5-nonoxypyrrolidin-2-one, (+-)-5-(Nonyloxy)-1-(phenylmethyl)-2-pyrrolidinone, 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)-, 1-BENZYL-5-(NONYLOXY)PYRROLIDIN-2-ONE, 5-(Nonyloxy)-1-[benzyl]pyrrolidin-2-one
| Molecular Formula | C20H31NO2 |
| Molecular Weight | 317.23547 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 317.23547 Da |
| Heavy Atoms | 23 |
| Complexity | 326.0 |
| SMILES | CCCCCCCCCOC1CCC(=O)N1CC2=CC=CC=C2 |
| InChIKey | VJCOGGRKMXCMJU-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- is 136410-44-1.
The molecular formula of 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- is C20H31NO2.
The molecular weight of 2-Pyrrolidinone, 5-(nonyloxy)-1-(phenylmethyl)-, (+-)- is 317.23547 g/mol.
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