4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine
TL;DR: 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine (CAS 104439-82-9) is a chemical compound with molecular formula C12H14N2 and molecular weight 186.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,5-dimethylpyrrol-1-yl)methyl]pyridine
Also Known As: 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine, 1-(4-pyridinylmethyl)-2,5-dimethylpyrrole, 4-[(2,5-dimethylpyrrol-1-yl)methyl]pyridine, 4-[(2,5-dimethyl-1H-pyrrol-1-yl)methyl]pyridine, J1.511.493B
| Molecular Formula | C12H14N2 |
|---|---|
| Molecular Weight | 186.12 g/mol |
| LogP | 2.54824 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.11569 |
| Heavy Atoms | 14 |
| Complexity | 395.6417 |
Chemical Identifiers
| CAS Number | 104439-82-9 |
|---|---|
| SMILES | CC1=CC=C(N1CC2=CC=NC=C2)C |
Product Overview
4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine (CAS 104439-82-9), with molecular formula C12H14N2 and molecular weight 186.12 g/mol. IUPAC: 4-[(2,5-dimethylpyrrol-1-yl)methyl]pyridine.
Chemical Property Profile of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine
Property Insights of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine
The XLogP value of 2.54824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine. With a topological polar surface area (TPSA) of 17.82 Ų, 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine 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 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine?
The CAS number of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine is 104439-82-9.
What is the molecular formula of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine?
The molecular formula of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine is C12H14N2.
What is the molecular weight of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine?
The molecular weight of 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine is 186.12 g/mol.
Where can I buy 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine?
You can request a quote for 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-((2,5-Dimethyl-1H-pyrrol-1-yl)methyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.