About 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine
1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine (PubChem CID 155207332) has the molecular formula C18H19N7
and a molecular weight of 333.40 g/mol. Its IUPAC name is 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine.
Molecular Properties
| Compound Name | 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine |
| PubChem CID | 155207332 |
| Molecular Formula | C18H19N7 |
| Molecular Weight | 333.40 g/mol |
| Exact Mass | 333.17 |
| IUPAC Name | 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine |
| SMILES | Cn1cc(-c2cc(-c3cn(C4CCC4)nc3N)c3ccnn3c2)cn1 |
| InChI | InChI=1S/C18H19N7/c1-23-9-13(8-21-23)12-7-15(17-5-6-20-25(17)10-12)16-11-24(22-18(16)19)14-3-2-4-14/h5-11,14H,2-4H2,1H3,(H2,19,22) |
| InChIKey | VXVSVLAGNJJFSR-UHFFFAOYSA-N |
| XLogP | 2.91 |
| TPSA | 78.96 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 333.40 |
| LogP ≤ 5 | 2.91 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine?
The IUPAC name of 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine (CID 155207332) is 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine.
What is the SMILES notation for 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine?
The canonical SMILES for 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine is Cn1cc(-c2cc(-c3cn(C4CCC4)nc3N)c3ccnn3c2)cn1.
What is the InChIKey of 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine?
The InChIKey is VXVSVLAGNJJFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7/c1-23-9-13(8-21-23)12-7-15(17-5-6-20-25(17)10-12)16-11-24(22-18(16)19)14-3-2-4-14/h5-11,14H,2-4H2,1H3,(H2,19,22).
What are the key properties of 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine?
1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine has a molecular weight of 333.40 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 155207332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).