About 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol
5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol (PubChem CID 90747187) has the molecular formula C11H13N3O
and a molecular weight of 203.25 g/mol. Its IUPAC name is 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol.
Molecular Properties
| Compound Name | 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol |
| PubChem CID | 90747187 |
| Molecular Formula | C11H13N3O |
| Molecular Weight | 203.25 g/mol |
| Exact Mass | 203.11 |
| IUPAC Name | 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol |
| SMILES | CCc1c(O)c(C)nn1-c1ccccn1 |
| InChI | InChI=1S/C11H13N3O/c1-3-9-11(15)8(2)13-14(9)10-6-4-5-7-12-10/h4-7,15H,3H2,1-2H3 |
| InChIKey | BMJGPXAKDDIVJX-UHFFFAOYSA-N |
| XLogP | 1.84 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 203.25 |
| LogP ≤ 5 | 1.84 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The IUPAC name of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol (CID 90747187) is 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol.
What is the SMILES notation for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The canonical SMILES for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol is CCc1c(O)c(C)nn1-c1ccccn1.
What is the InChIKey of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
The InChIKey is BMJGPXAKDDIVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-3-9-11(15)8(2)13-14(9)10-6-4-5-7-12-10/h4-7,15H,3H2,1-2H3.
What are the key properties of 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol?
5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol has a molecular weight of 203.25 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-1-pyridin-2-ylpyrazol-4-ol is sourced from PubChem (CID 90747187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).