About N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide
N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide (PubChem CID 2997575) has the molecular formula C14H16N4O
and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide.
Molecular Properties
| Compound Name | N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide |
| PubChem CID | 2997575 |
| Molecular Formula | C14H16N4O |
| Molecular Weight | 256.31 g/mol |
| Exact Mass | 256.13 |
| IUPAC Name | N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide |
| SMILES | Cc1cc(NC(=O)C2CCC2)n(-c2ccccn2)n1 |
| InChI | InChI=1S/C14H16N4O/c1-10-9-13(16-14(19)11-5-4-6-11)18(17-10)12-7-2-3-8-15-12/h2-3,7-9,11H,4-6H2,1H3,(H,16,19) |
| InChIKey | YVNYBSZWPFOLHA-UHFFFAOYSA-N |
| XLogP | 2.31 |
| TPSA | 59.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.31 |
| LogP ≤ 5 | 2.31 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide?
The IUPAC name of N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide (CID 2997575) is N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide.
What is the SMILES notation for N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide?
The canonical SMILES for N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide is Cc1cc(NC(=O)C2CCC2)n(-c2ccccn2)n1.
What is the InChIKey of N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide?
The InChIKey is YVNYBSZWPFOLHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-10-9-13(16-14(19)11-5-4-6-11)18(17-10)12-7-2-3-8-15-12/h2-3,7-9,11H,4-6H2,1H3,(H,16,19).
What are the key properties of N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide?
N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide has a molecular weight of 256.31 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)cyclobutanecarboxamide is sourced from PubChem (CID 2997575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).