6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid

C11H9N5O2 — CID 138663784

IUPAC6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid
SMILESCn1cc(-c2ccc3nc(C(=O)O)cn3n2)cn1
InChIInChI=1S/C11H9N5O2/c1-15-5-7(4-12-15)8-2-3-10-13-9(11(17)18)6-16(10)14-8/h2-6H,1H3,(H,17,18)
InChIKeyWLJIXZGWMAZCDQ-UHFFFAOYSA-N
MW243.23 g/mol
LogP0.83
Rot. Bonds2

About 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid

6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid (PubChem CID 138663784) has the molecular formula C11H9N5O2 and a molecular weight of 243.23 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid
PubChem CID138663784
Molecular FormulaC11H9N5O2
Molecular Weight243.23 g/mol
Exact Mass243.08
IUPAC Name6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid
SMILESCn1cc(-c2ccc3nc(C(=O)O)cn3n2)cn1
InChIInChI=1S/C11H9N5O2/c1-15-5-7(4-12-15)8-2-3-10-13-9(11(17)18)6-16(10)14-8/h2-6H,1H3,(H,17,18)
InChIKeyWLJIXZGWMAZCDQ-UHFFFAOYSA-N
XLogP0.83
TPSA85.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.23
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid 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 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The IUPAC name of 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid (CID 138663784) is 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid is Cn1cc(-c2ccc3nc(C(=O)O)cn3n2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The InChIKey is WLJIXZGWMAZCDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5O2/c1-15-5-7(4-12-15)8-2-3-10-13-9(11(17)18)6-16(10)14-8/h2-6H,1H3,(H,17,18).
What are the key properties of 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid?
6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid has a molecular weight of 243.23 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)imidazo[1,2-b]pyridazine-2-carboxylic acid is sourced from PubChem (CID 138663784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).