3-Amino-5-tert-butylpyrazole
TL;DR: 3-Amino-5-tert-butylpyrazole (CAS 1237537-54-0) is a chemical compound with molecular formula C7H13N3 and molecular weight 139.11095 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-tert-butyl-1H-pyrazol-3-amine
Also Known As: 3-Amino-5-tert-butylpyrazole, 5-tert-Butyl-1H-pyrazol-3-amine, 3-(tert-butyl)-1h-pyrazol-5-amine, 5-amino-3-tert-butylpyrazole, 3-tert-butyl-1H-pyrazol-5-amine
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H13N3 |
| Molecular Weight | 139.11095 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.11095 Da |
| Heavy Atoms | 10 |
| Complexity | 117.0 |
| SMILES | CC(C)(C)C1=CC(=NN1)N |
| InChIKey | ZHBXGHWSVIBUCQ-UHFFFAOYSA-N |
Chemical Property Profile of 3-Amino-5-tert-butylpyrazole
Property Insights of 3-Amino-5-tert-butylpyrazole
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-5-tert-butylpyrazole. With a topological polar surface area (TPSA) of 54.7 Ų, 3-Amino-5-tert-butylpyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-5-tert-butylpyrazole has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Amino-5-tert-butylpyrazole?
The CAS number of 3-Amino-5-tert-butylpyrazole is 1237537-54-0.
What is the molecular formula of 3-Amino-5-tert-butylpyrazole?
The molecular formula of 3-Amino-5-tert-butylpyrazole is C7H13N3.
What is the molecular weight of 3-Amino-5-tert-butylpyrazole?
The molecular weight of 3-Amino-5-tert-butylpyrazole is 139.11095 g/mol.
Where can I buy 3-Amino-5-tert-butylpyrazole?
You can request a quote for 3-Amino-5-tert-butylpyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Amino-5-tert-butylpyrazole?
Yes, CoreyChem provides custom synthesis services for 3-Amino-5-tert-butylpyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.