3-tert-butyl-1-phenyl-1H-pyrazol-5-amine
TL;DR: 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine (CAS 126208-61-5) is a chemical compound with molecular formula C13H17N3 and molecular weight 215.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-tert-butyl-1-phenylpyrazol-5-amine
Also Known As: 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine, 5-tert-Butyl-2-phenyl-2H-pyrazol-3-ylamine, 3-(tert-Butyl)-1-phenyl-1H-pyrazol-5-amine, 5-tert-butyl-2-phenylpyrazol-3-amine, 5-tert-Butyl-2-phenyl-2H-pyrazol-3-ylamin
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H17N3 |
| Molecular Weight | 215.14224 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.14224 Da |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
| SMILES | CC(C)(C)C1=NN(C(=C1)N)C2=CC=CC=C2 |
| InChIKey | GFWSTBBSSBVVQP-UHFFFAOYSA-N |
Chemical Property Profile of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine
Property Insights of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine
The XLogP value of 3.3 indicates that 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine has 1 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-tert-butyl-1-phenyl-1H-pyrazol-5-amine?
The CAS number of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine is 126208-61-5.
What is the molecular formula of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine?
The molecular formula of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine is C13H17N3.
What is the molecular weight of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine?
The molecular weight of 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine is 215.14224 g/mol.
Where can I buy 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine?
You can request a quote for 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine?
Yes, CoreyChem provides custom synthesis services for 3-tert-butyl-1-phenyl-1H-pyrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.