About (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone
(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone (PubChem CID 138010087) has the molecular formula C13H16N4O2
and a molecular weight of 260.30 g/mol. Its IUPAC name is (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone.
Molecular Properties
| Compound Name | (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone |
| PubChem CID | 138010087 |
| Molecular Formula | C13H16N4O2 |
| Molecular Weight | 260.30 g/mol |
| Exact Mass | 260.13 |
| IUPAC Name | (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone |
| SMILES | CO[C@H]1CCN(C(=O)c2cnn3ccc(N)cc23)C1 |
| InChI | InChI=1S/C13H16N4O2/c1-19-10-3-4-16(8-10)13(18)11-7-15-17-5-2-9(14)6-12(11)17/h2,5-7,10H,3-4,8,14H2,1H3/t10-/m0/s1 |
| InChIKey | GEOIPXKWFUDAMR-JTQLQIEISA-N |
| XLogP | 0.78 |
| TPSA | 72.86 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.30 |
| LogP ≤ 5 | 0.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone?
The IUPAC name of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone (CID 138010087) is (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone.
What is the SMILES notation for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone?
The canonical SMILES for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone is CO[C@H]1CCN(C(=O)c2cnn3ccc(N)cc23)C1.
What is the InChIKey of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone?
The InChIKey is GEOIPXKWFUDAMR-JTQLQIEISA-N. The full InChI is InChI=1S/C13H16N4O2/c1-19-10-3-4-16(8-10)13(18)11-7-15-17-5-2-9(14)6-12(11)17/h2,5-7,10H,3-4,8,14H2,1H3/t10-/m0/s1.
What are the key properties of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone?
(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone has a molecular weight of 260.30 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[(3S)-3-methoxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 138010087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).