About 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine
5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine (PubChem CID 142608441) has the molecular formula C19H23N5O2
and a molecular weight of 353.43 g/mol. Its IUPAC name is 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine.
Molecular Properties
| Compound Name | 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine |
| PubChem CID | 142608441 |
| Molecular Formula | C19H23N5O2 |
| Molecular Weight | 353.43 g/mol |
| Exact Mass | 353.19 |
| IUPAC Name | 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine |
| SMILES | CCOc1ncccc1-c1cc(N2CC[C@@H](OC)C2)c2c(cnn2C)n1 |
| InChI | InChI=1S/C19H23N5O2/c1-4-26-19-14(6-5-8-20-19)15-10-17(24-9-7-13(12-24)25-3)18-16(22-15)11-21-23(18)2/h5-6,8,10-11,13H,4,7,9,12H2,1-3H3/t13-/m1/s1 |
| InChIKey | SMGBPAKDYSNLHJ-CYBMUJFWSA-N |
| XLogP | 2.65 |
| TPSA | 65.30 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 353.43 |
| LogP ≤ 5 | 2.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine?
The IUPAC name of 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine (CID 142608441) is 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine.
What is the SMILES notation for 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine?
The canonical SMILES for 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine is CCOc1ncccc1-c1cc(N2CC[C@@H](OC)C2)c2c(cnn2C)n1.
What is the InChIKey of 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine?
The InChIKey is SMGBPAKDYSNLHJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-4-26-19-14(6-5-8-20-19)15-10-17(24-9-7-13(12-24)25-3)18-16(22-15)11-21-23(18)2/h5-6,8,10-11,13H,4,7,9,12H2,1-3H3/t13-/m1/s1.
What are the key properties of 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine?
5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine has a molecular weight of 353.43 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxy-3-pyridinyl)-7-[(3R)-3-methoxypyrrolidin-1-yl]-1-methylpyrazolo[4,5-b]pyridine is sourced from PubChem (CID 142608441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).