2,5-Dimethyl-3,4-dihydro-2H-pyrrole
TL;DR: 2,5-Dimethyl-3,4-dihydro-2H-pyrrole (CAS 822-64-0) is a chemical compound with molecular formula C6H11N and molecular weight 97.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-3,4-dihydro-2H-pyrrole
Also Known As: 2,5-Dimethyl-3,4-dihydro-2H-pyrrole, 2,5-Dimethylpyrroline, 2,5-Dimethyl-1-pyrroline, 3,4-DIHYDRO-2,5-DIMETHYL-2H-PYRROLE, 2,5-Dimethyl-3,4-dihydro-2H-pyrrole #
| Molecular Formula | C6H11N |
|---|---|
| Molecular Weight | 97.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 97.08915 |
| Heavy Atoms | 7 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 822-64-0 |
|---|---|
| SMILES | CC1CCC(=N1)C |
| InChIKey | HJDUCMRBFKTGNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dimethyl-3,4-dihydro-2H-pyrrole (CAS 822-64-0), with molecular formula C6H11N and molecular weight 97.09 g/mol. IUPAC: 2,5-dimethyl-3,4-dihydro-2H-pyrrole.
Chemical Property Profile of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole
Property Insights of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-3,4-dihydro-2H-pyrrole. With a topological polar surface area (TPSA) of 12.4 Ų, 2,5-Dimethyl-3,4-dihydro-2H-pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-3,4-dihydro-2H-pyrrole 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 2,5-Dimethyl-3,4-dihydro-2H-pyrrole?
The CAS number of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole is 822-64-0.
What is the molecular formula of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole?
The molecular formula of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole is C6H11N.
What is the molecular weight of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole?
The molecular weight of 2,5-Dimethyl-3,4-dihydro-2H-pyrrole is 97.09 g/mol.
Where can I buy 2,5-Dimethyl-3,4-dihydro-2H-pyrrole?
You can request a quote for 2,5-Dimethyl-3,4-dihydro-2H-pyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-3,4-dihydro-2H-pyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-3,4-dihydro-2H-pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.