3-Benzylpyrrolidine
TL;DR: 3-Benzylpyrrolidine (CAS 155627-32-0) is a chemical compound with molecular formula C11H15N and molecular weight 161.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-benzylpyrrolidine
Also Known As: 3-Benzylpyrrolidine, 3-benzyl-pyrrolidine, 3-benzylpyrroidine, Pyrrolidine, 3-(phenylmethyl)-, 3-(phenylmethyl)Pyrrolidine
Technical Specifications
| Molecular Formula | C11H15N |
| Molecular Weight | 161.12045 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.12045 Da |
| Heavy Atoms | 12 |
| Complexity | 127.0 |
| SMILES | C1CNCC1CC2=CC=CC=C2 |
| InChIKey | HFBLCYZEOGXHDP-UHFFFAOYSA-N |
Chemical Property Profile of 3-Benzylpyrrolidine
Property Insights of 3-Benzylpyrrolidine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzylpyrrolidine. With a topological polar surface area (TPSA) of 12.0 Ų, 3-Benzylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzylpyrrolidine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Benzylpyrrolidine?
The CAS number of 3-Benzylpyrrolidine is 155627-32-0.
What is the molecular formula of 3-Benzylpyrrolidine?
The molecular formula of 3-Benzylpyrrolidine is C11H15N.
What is the molecular weight of 3-Benzylpyrrolidine?
The molecular weight of 3-Benzylpyrrolidine is 161.12045 g/mol.
Where can I buy 3-Benzylpyrrolidine?
You can request a quote for 3-Benzylpyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Benzylpyrrolidine?
Yes, CoreyChem provides custom synthesis services for 3-Benzylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.