1-benzyl-3-methyl-1H-pyrazol-5-amine
TL;DR: 1-benzyl-3-methyl-1H-pyrazol-5-amine (CAS 386715-46-4) 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.
2-benzyl-5-methylpyrazol-3-amine
Also Known As: 1-benzyl-3-methyl-1H-pyrazol-5-amine, 2-Benzyl-5-methyl-2H-pyrazol-3-ylamine, 2-benzyl-5-methylpyrazol-3-amine, starbld0008926, 1H-Pyrazol-5-amine, 3-methyl-1-(phenylmethyl)-
| Molecular Formula | C11H13N3 |
|---|---|
| Molecular Weight | 187.11 g/mol |
| LogP | 1.9 |
| 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 | 386715-46-4 |
|---|---|
| SMILES | CC1=NN(C(=C1)N)CC2=CC=CC=C2 |
| InChIKey | WRHZMJSDCJXWDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-benzyl-3-methyl-1H-pyrazol-5-amine (CAS 386715-46-4), with molecular formula C11H13N3 and molecular weight 187.11 g/mol. IUPAC: 2-benzyl-5-methylpyrazol-3-amine.
Chemical Property Profile of 1-benzyl-3-methyl-1H-pyrazol-5-amine
Property Insights of 1-benzyl-3-methyl-1H-pyrazol-5-amine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-3-methyl-1H-pyrazol-5-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 1-benzyl-3-methyl-1H-pyrazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-3-methyl-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
Frequently Asked Questions
What is the CAS number of 1-benzyl-3-methyl-1H-pyrazol-5-amine?
The CAS number of 1-benzyl-3-methyl-1H-pyrazol-5-amine is 386715-46-4.
What is the molecular formula of 1-benzyl-3-methyl-1H-pyrazol-5-amine?
The molecular formula of 1-benzyl-3-methyl-1H-pyrazol-5-amine is C11H13N3.
What is the molecular weight of 1-benzyl-3-methyl-1H-pyrazol-5-amine?
The molecular weight of 1-benzyl-3-methyl-1H-pyrazol-5-amine is 187.11 g/mol.
Where can I buy 1-benzyl-3-methyl-1H-pyrazol-5-amine?
You can request a quote for 1-benzyl-3-methyl-1H-pyrazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-3-methyl-1H-pyrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-3-methyl-1H-pyrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.