About 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one
2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 91895193) has the molecular formula C11H9N5O2
and a molecular weight of 243.23 g/mol. Its IUPAC name is 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one.
Molecular Properties
| Compound Name | 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one |
| PubChem CID | 91895193 |
| Molecular Formula | C11H9N5O2 |
| Molecular Weight | 243.23 g/mol |
| Exact Mass | 243.08 |
| IUPAC Name | 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one |
| SMILES | Cc1cn2nc(C(=O)n3ccnc3)cc2c(=O)[nH]1 |
| InChI | InChI=1S/C11H9N5O2/c1-7-5-16-9(10(17)13-7)4-8(14-16)11(18)15-3-2-12-6-15/h2-6H,1H3,(H,13,17) |
| InChIKey | GPAKHOBCLZMLPS-UHFFFAOYSA-N |
| XLogP | 0.22 |
| TPSA | 85.05 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 243.23 |
| LogP ≤ 5 | 0.22 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one (CID 91895193) is 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one is Cc1cn2nc(C(=O)n3ccnc3)cc2c(=O)[nH]1.
What is the InChIKey of 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is GPAKHOBCLZMLPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O2/c1-7-5-16-9(10(17)13-7)4-8(14-16)11(18)15-3-2-12-6-15/h2-6H,1H3,(H,13,17).
What are the key properties of 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 243.23 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazole-1-carbonyl)-6-methyl-5H-pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 91895193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).