1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone

C9H10N4O — CID 2735244

IUPAC1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone
SMILESCC(=O)c1nnc2cc(C)nn2c1C
InChIInChI=1S/C9H10N4O/c1-5-4-8-10-11-9(7(3)14)6(2)13(8)12-5/h4H,1-3H3
InChIKeyPQIOJSDFJAOESL-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.94
Rot. Bonds1

About 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone

1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone (PubChem CID 2735244) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone.

Molecular Properties

Compound Name1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone
PubChem CID2735244
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone
SMILESCC(=O)c1nnc2cc(C)nn2c1C
InChIInChI=1S/C9H10N4O/c1-5-4-8-10-11-9(7(3)14)6(2)13(8)12-5/h4H,1-3H3
InChIKeyPQIOJSDFJAOESL-UHFFFAOYSA-N
XLogP0.94
TPSA60.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone 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 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone?
The IUPAC name of 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone (CID 2735244) is 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone.
What is the SMILES notation for 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone?
The canonical SMILES for 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone is CC(=O)c1nnc2cc(C)nn2c1C.
What is the InChIKey of 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone?
The InChIKey is PQIOJSDFJAOESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-5-4-8-10-11-9(7(3)14)6(2)13(8)12-5/h4H,1-3H3.
What are the key properties of 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone?
1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone has a molecular weight of 190.21 g/mol, XLogP of 0.94, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,7-dimethylpyrazolo[5,1-c][1,2,4]triazin-3-yl)ethanone is sourced from PubChem (CID 2735244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).