![4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline structure](/static/products/1030/1030378-93-8.webp)
4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
TL;DR: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline (CAS 1030378-93-8) is a chemical compound with molecular formula C12H15N3 and molecular weight 201.1266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
Also Known As: 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline, 4-(3,5-Dimethyl-1H-pyrazol-4-ylmethyl)-phenylamine, 7719AC, BAS 07246362, 4-((3,5-Dimethyl-1H-pyrazol-4-yl)methyl)aniline
Technical Specifications
| Molecular Formula | C12H15N3 |
| Molecular Weight | 201.1266 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.1266 Da |
| Heavy Atoms | 15 |
| Complexity | 199.0 |
| SMILES | CC1=C(C(=NN1)C)CC2=CC=C(C=C2)N |
| InChIKey | NRJBRDIARLROID-UHFFFAOYSA-N |
Chemical Property Profile of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
Property Insights of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline. With a topological polar surface area (TPSA) of 54.7 Ų, 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline 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 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline?
The CAS number of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline is 1030378-93-8.
What is the molecular formula of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline?
The molecular formula of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline is C12H15N3.
What is the molecular weight of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline?
The molecular weight of 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline is 201.1266 g/mol.
Where can I buy 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline?
You can request a quote for 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline?
Yes, CoreyChem provides custom synthesis services for 4-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.