2,5-Dihydro-1-methylpyrrole
TL;DR: 2,5-Dihydro-1-methylpyrrole (CAS 554-15-4) is a chemical compound with molecular formula CN1CC=CC1 and molecular weight 83.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2,5-dihydropyrrole
Also Known As: n-methylpyrroline, 2,5-Dihydro-1-methylpyrrole, 1-methyl-2,5-dihydropyrrole, 1-methyl-2,5-dihydro-1h-pyrrole, 2,5-DIHYDRO-1-METHYL-1H-PYRROLE
| Molecular Formula | CN1CC=CC1 |
|---|---|
| Molecular Weight | 83.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 83.0735 |
| Heavy Atoms | 6 |
| Complexity | 58.0 |
Chemical Identifiers
| CAS Number | 554-15-4 |
|---|---|
| SMILES | CN1CC=CC1 |
| InChIKey | AHVYPIQETPWLSZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dihydro-1-methylpyrrole (CAS 554-15-4), with molecular formula CN1CC=CC1 and molecular weight 83.07 g/mol. IUPAC: 1-methyl-2,5-dihydropyrrole.
Chemical Property Profile of 2,5-Dihydro-1-methylpyrrole
Property Insights of 2,5-Dihydro-1-methylpyrrole
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dihydro-1-methylpyrrole. With a topological polar surface area (TPSA) of 3.2 Ų, 2,5-Dihydro-1-methylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dihydro-1-methylpyrrole 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-Dihydro-1-methylpyrrole?
The CAS number of 2,5-Dihydro-1-methylpyrrole is 554-15-4.
What is the molecular formula of 2,5-Dihydro-1-methylpyrrole?
The molecular formula of 2,5-Dihydro-1-methylpyrrole is CN1CC=CC1.
What is the molecular weight of 2,5-Dihydro-1-methylpyrrole?
The molecular weight of 2,5-Dihydro-1-methylpyrrole is 83.07 g/mol.
Where can I buy 2,5-Dihydro-1-methylpyrrole?
You can request a quote for 2,5-Dihydro-1-methylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dihydro-1-methylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dihydro-1-methylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.