4-Methyl-5-phenyl-2H-pyrazol-3-ylamine
TL;DR: 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine (CAS 21169-71-1) is a chemical compound with molecular formula C10H11N3 and molecular weight 173.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-phenyl-1H-pyrazol-3-amine
Also Known As: 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine, 4-methyl-5-phenyl-1H-pyrazol-3-amine, 4-METHYL-3-PHENYL-1H-PYRAZOL-5-AMINE, 3-Amino-4-methyl-5-phenylpyrazole, Isoxazole-5-carboxylic acid
| Molecular Formula | C10H11N3 |
|---|---|
| Molecular Weight | 173.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.09529 |
| Heavy Atoms | 13 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 21169-71-1 |
|---|---|
| SMILES | CC1=C(NN=C1N)C2=CC=CC=C2 |
| InChIKey | PJNHMZXAVFWBIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-5-phenyl-2H-pyrazol-3-ylamine (CAS 21169-71-1), with molecular formula C10H11N3 and molecular weight 173.10 g/mol. IUPAC: 4-methyl-5-phenyl-1H-pyrazol-3-amine.
Chemical Property Profile of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine
Property Insights of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine. With a topological polar surface area (TPSA) of 54.7 Ų, 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine 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
Frequently Asked Questions
What is the CAS number of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine?
The CAS number of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine is 21169-71-1.
What is the molecular formula of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine?
The molecular formula of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine is C10H11N3.
What is the molecular weight of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine?
The molecular weight of 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine is 173.10 g/mol.
Where can I buy 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine?
You can request a quote for 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-5-phenyl-2H-pyrazol-3-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.