2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide

C19H20N8O2 — CID 166803519

IUPAC2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide
SMILESCC(C)c1nn(CC(=O)Nc2ccn3cnnc3c2)c(=O)c2cc(C3CC3)nn12
InChIInChI=1S/C19H20N8O2/c1-11(2)18-24-26(19(29)15-8-14(12-3-4-12)23-27(15)18)9-17(28)21-13-5-6-25-10-20-22-16(25)7-13/h5-8,10-12H,3-4,9H2,1-2H3,(H,21,28)
InChIKeyCHHGPICRQLCNFI-UHFFFAOYSA-N
MW392.42 g/mol
LogP1.57
Rot. Bonds5

About 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide

2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide (PubChem CID 166803519) has the molecular formula C19H20N8O2 and a molecular weight of 392.42 g/mol. Its IUPAC name is 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide
PubChem CID166803519
Molecular FormulaC19H20N8O2
Molecular Weight392.42 g/mol
Exact Mass392.17
IUPAC Name2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide
SMILESCC(C)c1nn(CC(=O)Nc2ccn3cnnc3c2)c(=O)c2cc(C3CC3)nn12
InChIInChI=1S/C19H20N8O2/c1-11(2)18-24-26(19(29)15-8-14(12-3-4-12)23-27(15)18)9-17(28)21-13-5-6-25-10-20-22-16(25)7-13/h5-8,10-12H,3-4,9H2,1-2H3,(H,21,28)
InChIKeyCHHGPICRQLCNFI-UHFFFAOYSA-N
XLogP1.57
TPSA111.48 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.42
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide?
The IUPAC name of 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide (CID 166803519) is 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide.
What is the SMILES notation for 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide?
The canonical SMILES for 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide is CC(C)c1nn(CC(=O)Nc2ccn3cnnc3c2)c(=O)c2cc(C3CC3)nn12.
What is the InChIKey of 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide?
The InChIKey is CHHGPICRQLCNFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N8O2/c1-11(2)18-24-26(19(29)15-8-14(12-3-4-12)23-27(15)18)9-17(28)21-13-5-6-25-10-20-22-16(25)7-13/h5-8,10-12H,3-4,9H2,1-2H3,(H,21,28).
What are the key properties of 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide?
2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide has a molecular weight of 392.42 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-7-yl)acetamide is sourced from PubChem (CID 166803519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).