3-Amino-1-methylpyridinium
TL;DR: 3-Amino-1-methylpyridinium (CAS 45642-86-2) is a chemical compound with molecular formula C6H9N2+ and molecular weight 109.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylpyridin-1-ium-3-amine
Also Known As: 3-amino-1-methylpyridinium, 3-Amino-1-methylpyridin-1-ium, 1-methylpyridin-1-ium-3-amine, 1-Methyl-3-aminopyridinium, 1-METHYL-1,6-DIHYDROPYRIDIN-3-AMINE
| Molecular Formula | C6H9N2+ |
|---|---|
| Molecular Weight | 109.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 109.07658 |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 45642-86-2 |
|---|---|
| SMILES | C[N+]1=CC=CC(=C1)N |
| InChIKey | MVZHRMOZEJOWBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-1-methylpyridinium (CAS 45642-86-2), with molecular formula C6H9N2+ and molecular weight 109.08 g/mol. IUPAC: 1-methylpyridin-1-ium-3-amine.
Chemical Property Profile of 3-Amino-1-methylpyridinium
Property Insights of 3-Amino-1-methylpyridinium
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1-methylpyridinium. With a topological polar surface area (TPSA) of 29.9 Ų, 3-Amino-1-methylpyridinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-methylpyridinium has 1 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 3-Amino-1-methylpyridinium?
The CAS number of 3-Amino-1-methylpyridinium is 45642-86-2.
What is the molecular formula of 3-Amino-1-methylpyridinium?
The molecular formula of 3-Amino-1-methylpyridinium is C6H9N2+.
What is the molecular weight of 3-Amino-1-methylpyridinium?
The molecular weight of 3-Amino-1-methylpyridinium is 109.08 g/mol.
Where can I buy 3-Amino-1-methylpyridinium?
You can request a quote for 3-Amino-1-methylpyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1-methylpyridinium?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-methylpyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.