N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine
TL;DR: N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine (CAS 869942-05-2) is a chemical compound with molecular formula C8H13N5 and molecular weight 179.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-N-(1,2,4-triazol-4-yl)piperidin-4-imine
Also Known As: 1-methyl-N-(1,2,4-triazol-4-yl)piperidin-4-imine, N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine, 1-Methyl-N-(4H-1,2,4-triazol-4-yl)piperidin-4-imine
| Molecular Formula | C8H13N5 |
|---|---|
| Molecular Weight | 179.12 g/mol |
| LogP | 0.2078 |
| Topological Polar Surface Area | 46.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.1171 |
| Heavy Atoms | 13 |
| Complexity | 279.49286 |
Chemical Identifiers
| CAS Number | 869942-05-2 |
|---|---|
| SMILES | CN1CCC(=NN2C=NN=C2)CC1 |
Product Overview
N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine (CAS 869942-05-2), with molecular formula C8H13N5 and molecular weight 179.12 g/mol. IUPAC: 1-methyl-N-(1,2,4-triazol-4-yl)piperidin-4-imine.
Chemical Property Profile of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine
Property Insights of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine
The XLogP value of 0.2078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 46.31 Ų, N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine has 0 hydrogen bond donor(s) and 4 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 N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine?
The CAS number of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine is 869942-05-2.
What is the molecular formula of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine?
The molecular formula of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine is C8H13N5.
What is the molecular weight of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine?
The molecular weight of N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine is 179.12 g/mol.
Where can I buy N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine?
You can request a quote for N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Methyl-4-piperidinylidene)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.