About 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine
3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 102589453) has the molecular formula C14H14N4
and a molecular weight of 238.29 g/mol. Its IUPAC name is 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine.
Molecular Properties
| Compound Name | 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine |
| PubChem CID | 102589453 |
| Molecular Formula | C14H14N4 |
| Molecular Weight | 238.29 g/mol |
| Exact Mass | 238.12 |
| IUPAC Name | 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine |
| SMILES | Cc1ccc(-c2cnc(N)c3cnc(C)n23)cc1 |
| InChI | InChI=1S/C14H14N4/c1-9-3-5-11(6-4-9)12-7-17-14(15)13-8-16-10(2)18(12)13/h3-8H,1-2H3,(H2,15,17) |
| InChIKey | OFMJQXHVLKRREA-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 56.21 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 238.29 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine (CID 102589453) is 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine is Cc1ccc(-c2cnc(N)c3cnc(C)n23)cc1.
What is the InChIKey of 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is OFMJQXHVLKRREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-3-5-11(6-4-9)12-7-17-14(15)13-8-16-10(2)18(12)13/h3-8H,1-2H3,(H2,15,17).
What are the key properties of 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine?
3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 238.29 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(4-methylphenyl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 102589453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).