TL;DR: 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- (CAS 136410-12-3) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15213 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzoyl-5-pentoxypyrrolidin-2-one
Also Known As: (+-)-1-Benzoyl-5-(pentyloxy)-2-pyrrolidinone, 1-benzoyl-5-pentoxypyrrolidin-2-one, 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)-, 1-benzoyl 5-n-pentyloxy pyrrolidin-2-one, 1-BENZOYL-5-(PENTYLOXY)PYRROLIDIN-2-ONE
| Molecular Formula | C16H21NO3 |
| Molecular Weight | 275.15213 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.15213 Da |
| Heavy Atoms | 20 |
| Complexity | 337.0 |
| SMILES | CCCCCOC1CCC(=O)N1C(=O)C2=CC=CC=C2 |
| InChIKey | BIVKELXEBMGXEO-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- is 136410-12-3.
The molecular formula of 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- is C16H21NO3.
The molecular weight of 2-Pyrrolidinone, 1-benzoyl-5-(pentyloxy)-, (+-)- is 275.15213 g/mol.
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