About 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide
5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide (PubChem CID 135132360) has the molecular formula C19H15F3N6O
and a molecular weight of 400.36 g/mol. Its IUPAC name is 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide.
Molecular Properties
| Compound Name | 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide |
| PubChem CID | 135132360 |
| Molecular Formula | C19H15F3N6O |
| Molecular Weight | 400.36 g/mol |
| Exact Mass | 400.13 |
| IUPAC Name | 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide |
| SMILES | Cc1c(C(=O)Nc2ccnc(C(F)(F)F)c2)cnn1-c1ccc(C)n2nccc12 |
| InChI | InChI=1S/C19H15F3N6O/c1-11-3-4-15(16-6-8-24-27(11)16)28-12(2)14(10-25-28)18(29)26-13-5-7-23-17(9-13)19(20,21)22/h3-10H,1-2H3,(H,23,26,29) |
| InChIKey | JLPSYWYOWMSEGP-UHFFFAOYSA-N |
| XLogP | 3.80 |
| TPSA | 77.11 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 400.36 |
| LogP ≤ 5 | 3.80 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 6 |
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Frequently Asked Questions
What is the IUPAC name of 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide?
The IUPAC name of 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide (CID 135132360) is 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide is Cc1c(C(=O)Nc2ccnc(C(F)(F)F)c2)cnn1-c1ccc(C)n2nccc12.
What is the InChIKey of 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide?
The InChIKey is JLPSYWYOWMSEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N6O/c1-11-3-4-15(16-6-8-24-27(11)16)28-12(2)14(10-25-28)18(29)26-13-5-7-23-17(9-13)19(20,21)22/h3-10H,1-2H3,(H,23,26,29).
What are the key properties of 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide?
5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide has a molecular weight of 400.36 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(7-methylpyrazolo[1,5-a]pyridin-4-yl)-N-[2-(trifluoromethyl)-4-pyridinyl]pyrazole-4-carboxamide is sourced from PubChem (CID 135132360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).