1-methyl-1H-1,2,4-triazol-5-amine
TL;DR: 1-methyl-1H-1,2,4-triazol-5-amine (CAS 158511-58-1) is a chemical compound with molecular formula C3H6N4 and molecular weight 98.05925 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-1,2,4-triazol-3-amine
Also Known As: 1-methyl-1h-1,2,4-triazol-5-amine, 2-methyl-1,2,4-triazol-3-amine, 1-Methyl-1H-1,2,4-triazole-5-amine, 1H-1,2,4-Triazol-5-amine, 1-methyl-, 5-Amino-1-methyl-1,2,4-triazole
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H6N4 |
| Molecular Weight | 98.05925 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.05925 Da |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
| SMILES | CN1C(=NC=N1)N |
| InChIKey | XBTDXUGMCUNQDP-UHFFFAOYSA-N |
Chemical Property Profile of 1-methyl-1H-1,2,4-triazol-5-amine
Property Insights of 1-methyl-1H-1,2,4-triazol-5-amine
The XLogP value of -0.3 indicates that 1-methyl-1H-1,2,4-triazol-5-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.7 Ų, 1-methyl-1H-1,2,4-triazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-1H-1,2,4-triazol-5-amine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-methyl-1H-1,2,4-triazol-5-amine?
The CAS number of 1-methyl-1H-1,2,4-triazol-5-amine is 158511-58-1.
What is the molecular formula of 1-methyl-1H-1,2,4-triazol-5-amine?
The molecular formula of 1-methyl-1H-1,2,4-triazol-5-amine is C3H6N4.
What is the molecular weight of 1-methyl-1H-1,2,4-triazol-5-amine?
The molecular weight of 1-methyl-1H-1,2,4-triazol-5-amine is 98.05925 g/mol.
Where can I buy 1-methyl-1H-1,2,4-triazol-5-amine?
You can request a quote for 1-methyl-1H-1,2,4-triazol-5-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-methyl-1H-1,2,4-triazol-5-amine?
Yes, CoreyChem provides custom synthesis services for 1-methyl-1H-1,2,4-triazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.