1-Benzyl-3-(p-tolyl)pyrrolidine
TL;DR: 1-Benzyl-3-(p-tolyl)pyrrolidine (CAS 220474-58-8) is a chemical compound with molecular formula C18H21N and molecular weight 251.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-(4-methylphenyl)pyrrolidine
Also Known As: 1-Benzyl-3-p-tolylpyrrolidine, 1-benzyl-3-(4-methylphenyl)pyrrolidine, 1-benzyl-3-(p-tolyl)pyrrolidine, J1.025.818I
| Molecular Formula | C18H21N |
|---|---|
| Molecular Weight | 251.17 g/mol |
| LogP | 3.98452 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.1674 |
| Heavy Atoms | 19 |
| Complexity | 515.14636 |
Chemical Identifiers
| CAS Number | 220474-58-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CCN(C2)CC3=CC=CC=C3 |
Product Overview
1-Benzyl-3-(p-tolyl)pyrrolidine (CAS 220474-58-8), with molecular formula C18H21N and molecular weight 251.17 g/mol. IUPAC: 1-benzyl-3-(4-methylphenyl)pyrrolidine.
Chemical Property Profile of 1-Benzyl-3-(p-tolyl)pyrrolidine
Property Insights of 1-Benzyl-3-(p-tolyl)pyrrolidine
The XLogP value of 3.98452 indicates that 1-Benzyl-3-(p-tolyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 1-Benzyl-3-(p-tolyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-(p-tolyl)pyrrolidine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Benzyl-3-(p-tolyl)pyrrolidine?
The CAS number of 1-Benzyl-3-(p-tolyl)pyrrolidine is 220474-58-8.
What is the molecular formula of 1-Benzyl-3-(p-tolyl)pyrrolidine?
The molecular formula of 1-Benzyl-3-(p-tolyl)pyrrolidine is C18H21N.
What is the molecular weight of 1-Benzyl-3-(p-tolyl)pyrrolidine?
The molecular weight of 1-Benzyl-3-(p-tolyl)pyrrolidine is 251.17 g/mol.
Where can I buy 1-Benzyl-3-(p-tolyl)pyrrolidine?
You can request a quote for 1-Benzyl-3-(p-tolyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-(p-tolyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-(p-tolyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.