N-benzyl-3-benzoyloxypyrrolidine
TL;DR: N-benzyl-3-benzoyloxypyrrolidine (CAS 122929-21-9) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14157 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1-benzylpyrrolidin-3-yl) benzoate
Also Known As: N-benzyl-3-benzoyloxypyrrolidine, 1-benzylpyrrolidin-3-yl benzoate, (1-benzylpyrrolidin-3-yl) benzoate
Technical Specifications
| Molecular Formula | C18H19NO2 |
| Molecular Weight | 281.14157 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.14157 Da |
| Heavy Atoms | 21 |
| Complexity | 332.0 |
| SMILES | C1CN(CC1OC(=O)C2=CC=CC=C2)CC3=CC=CC=C3 |
| InChIKey | QVPCHUSMYXRTHF-UHFFFAOYSA-N |
Chemical Property Profile of N-benzyl-3-benzoyloxypyrrolidine
Property Insights of N-benzyl-3-benzoyloxypyrrolidine
The XLogP value of 3.5 indicates that N-benzyl-3-benzoyloxypyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, N-benzyl-3-benzoyloxypyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-3-benzoyloxypyrrolidine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-benzyl-3-benzoyloxypyrrolidine?
The CAS number of N-benzyl-3-benzoyloxypyrrolidine is 122929-21-9.
What is the molecular formula of N-benzyl-3-benzoyloxypyrrolidine?
The molecular formula of N-benzyl-3-benzoyloxypyrrolidine is C18H19NO2.
What is the molecular weight of N-benzyl-3-benzoyloxypyrrolidine?
The molecular weight of N-benzyl-3-benzoyloxypyrrolidine is 281.14157 g/mol.
Where can I buy N-benzyl-3-benzoyloxypyrrolidine?
You can request a quote for N-benzyl-3-benzoyloxypyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-benzyl-3-benzoyloxypyrrolidine?
Yes, CoreyChem provides custom synthesis services for N-benzyl-3-benzoyloxypyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.