About 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (PubChem CID 75522082) has the molecular formula C14H15N5O2
and a molecular weight of 285.31 g/mol. Its IUPAC name is 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.
Molecular Properties
| Compound Name | 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide |
| PubChem CID | 75522082 |
| Molecular Formula | C14H15N5O2 |
| Molecular Weight | 285.31 g/mol |
| Exact Mass | 285.12 |
| IUPAC Name | 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide |
| SMILES | Cc1cc(NC(=O)Cn2ccc(C)c(C#N)c2=O)n(C)n1 |
| InChI | InChI=1S/C14H15N5O2/c1-9-4-5-19(14(21)11(9)7-15)8-13(20)16-12-6-10(2)17-18(12)3/h4-6H,8H2,1-3H3,(H,16,20) |
| InChIKey | KUOBSTRACYOZLP-UHFFFAOYSA-N |
| XLogP | 0.71 |
| TPSA | 92.71 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 285.31 |
| LogP ≤ 5 | 0.71 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (CID 75522082) is 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is Cc1cc(NC(=O)Cn2ccc(C)c(C#N)c2=O)n(C)n1.
What is the InChIKey of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The InChIKey is KUOBSTRACYOZLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-9-4-5-19(14(21)11(9)7-15)8-13(20)16-12-6-10(2)17-18(12)3/h4-6H,8H2,1-3H3,(H,16,20).
What are the key properties of 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide has a molecular weight of 285.31 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyano-4-methyl-2-oxo-1-pyridinyl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is sourced from PubChem (CID 75522082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).