N-(2,4-Dimethylphenyl)pyrrolidine
TL;DR: N-(2,4-Dimethylphenyl)pyrrolidine (CAS 81506-12-9) is a chemical compound with molecular formula C12H17N and molecular weight 175.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethylphenyl)pyrrolidine
Also Known As: N-(2,4-Dimethylphenyl)pyrrolidine, 1-(2,4-dimethylphenyl)pyrrolidine, RefChem:360158
| Molecular Formula | C12H17N |
|---|---|
| Molecular Weight | 175.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.1361 |
| Heavy Atoms | 13 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 81506-12-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2CCCC2)C |
| InChIKey | SWPBMUDCQZVHFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,4-Dimethylphenyl)pyrrolidine (CAS 81506-12-9), with molecular formula C12H17N and molecular weight 175.14 g/mol. IUPAC: 1-(2,4-dimethylphenyl)pyrrolidine.
Chemical Property Profile of N-(2,4-Dimethylphenyl)pyrrolidine
Property Insights of N-(2,4-Dimethylphenyl)pyrrolidine
The XLogP value of 3.3 indicates that N-(2,4-Dimethylphenyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N-(2,4-Dimethylphenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2,4-Dimethylphenyl)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 N-(2,4-Dimethylphenyl)pyrrolidine?
The CAS number of N-(2,4-Dimethylphenyl)pyrrolidine is 81506-12-9.
What is the molecular formula of N-(2,4-Dimethylphenyl)pyrrolidine?
The molecular formula of N-(2,4-Dimethylphenyl)pyrrolidine is C12H17N.
What is the molecular weight of N-(2,4-Dimethylphenyl)pyrrolidine?
The molecular weight of N-(2,4-Dimethylphenyl)pyrrolidine is 175.14 g/mol.
Where can I buy N-(2,4-Dimethylphenyl)pyrrolidine?
You can request a quote for N-(2,4-Dimethylphenyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dimethylphenyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dimethylphenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.