About 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 9360932) has the molecular formula C22H26N4O3
and a molecular weight of 394.48 g/mol. Its IUPAC name is 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
Molecular Properties
| Compound Name | 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide |
| PubChem CID | 9360932 |
| Molecular Formula | C22H26N4O3 |
| Molecular Weight | 394.48 g/mol |
| Exact Mass | 394.20 |
| IUPAC Name | 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide |
| SMILES | CCOc1ccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)cc1OC |
| InChI | InChI=1S/C22H26N4O3/c1-5-29-19-9-8-15(10-20(19)28-4)24-22(27)16-11-18(14-6-7-14)25-21-17(16)12-23-26(21)13(2)3/h8-14H,5-7H2,1-4H3,(H,24,27) |
| InChIKey | UVEQVKWZXXXWEJ-UHFFFAOYSA-N |
| XLogP | 4.55 |
| TPSA | 78.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 394.48 |
| LogP ≤ 5 | 4.55 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide (CID 9360932) is 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is CCOc1ccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)cc1OC.
What is the InChIKey of 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is UVEQVKWZXXXWEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3/c1-5-29-19-9-8-15(10-20(19)28-4)24-22(27)16-11-18(14-6-7-14)25-21-17(16)12-23-26(21)13(2)3/h8-14H,5-7H2,1-4H3,(H,24,27).
What are the key properties of 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 394.48 g/mol, XLogP of 4.55, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-(4-ethoxy-3-methoxyphenyl)-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9360932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).