2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide

C17H18N10O2 — CID 166803160

IUPAC2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide
SMILESCC(C)c1nn(CC(=O)Nc2ccc3nnnn3n2)c(=O)c2cc(C3CC3)nn12
InChIInChI=1S/C17H18N10O2/c1-9(2)16-22-25(17(29)12-7-11(10-3-4-10)20-26(12)16)8-15(28)18-13-5-6-14-19-23-24-27(14)21-13/h5-7,9-10H,3-4,8H2,1-2H3,(H,18,21,28)
InChIKeyDGPHNDLKWXPMTF-UHFFFAOYSA-N
MW394.40 g/mol
LogP0.36
Rot. Bonds5

About 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide

2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide (PubChem CID 166803160) has the molecular formula C17H18N10O2 and a molecular weight of 394.40 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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide.

Molecular Properties

Compound Name2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide
PubChem CID166803160
Molecular FormulaC17H18N10O2
Molecular Weight394.40 g/mol
Exact Mass394.16
IUPAC Name2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide
SMILESCC(C)c1nn(CC(=O)Nc2ccc3nnnn3n2)c(=O)c2cc(C3CC3)nn12
InChIInChI=1S/C17H18N10O2/c1-9(2)16-22-25(17(29)12-7-11(10-3-4-10)20-26(12)16)8-15(28)18-13-5-6-14-19-23-24-27(14)21-13/h5-7,9-10H,3-4,8H2,1-2H3,(H,18,21,28)
InChIKeyDGPHNDLKWXPMTF-UHFFFAOYSA-N
XLogP0.36
TPSA137.26 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.40
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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-(tetrazolo[1,5-b]pyridazin-6-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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide (CID 166803160) is 2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-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-(tetrazolo[1,5-b]pyridazin-6-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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide is CC(C)c1nn(CC(=O)Nc2ccc3nnnn3n2)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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide?
The InChIKey is DGPHNDLKWXPMTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N10O2/c1-9(2)16-22-25(17(29)12-7-11(10-3-4-10)20-26(12)16)8-15(28)18-13-5-6-14-19-23-24-27(14)21-13/h5-7,9-10H,3-4,8H2,1-2H3,(H,18,21,28).
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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide?
2-(2-cyclopropyl-4-oxo-7-propan-2-ylpyrazolo[1,5-d][1,2,4]triazin-5-yl)-N-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide has a molecular weight of 394.40 g/mol, XLogP of 0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 11 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-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide is sourced from PubChem (CID 166803160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).