2-Benzyl-4-methyl-2H-pyrazol-3-ylamine
TL;DR: 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine (CAS 3528-49-2) is a chemical compound with molecular formula C11H13N3 and molecular weight 187.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-methylpyrazol-5-amine
Also Known As: 1-benzyl-4-methyl-1h-pyrazol-5-amine, 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine, 2-benzyl-4-methylpyrazol-3-amine, CHEMBRDG-BB 4014367, 2-benzyl-4-methyl-pyrazol-3-amine
| Molecular Formula | C11H13N3 |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.11095 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 3528-49-2 |
|---|---|
| SMILES | CC1=C(N(N=C1)CC2=CC=CC=C2)N |
| InChIKey | SVINJSJPUAJVMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Benzyl-4-methyl-2H-pyrazol-3-ylamine (CAS 3528-49-2), with molecular formula C11H13N3 and molecular weight 187.11 g/mol. IUPAC: 1-benzyl-4-methylpyrazol-5-amine.
Chemical Property Profile of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine
Property Insights of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine. With a topological polar surface area (TPSA) of 43.8 Ų, 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine 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
Frequently Asked Questions
What is the CAS number of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine?
The CAS number of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine is 3528-49-2.
What is the molecular formula of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine?
The molecular formula of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine is C11H13N3.
What is the molecular weight of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine?
The molecular weight of 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine is 187.11 g/mol.
Where can I buy 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine?
You can request a quote for 2-Benzyl-4-methyl-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 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-4-methyl-2H-pyrazol-3-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.