6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid

C10H12N4O2 — CID 84685599

IUPAC6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid
SMILESCC(C)Nc1ccc2nc(C(=O)O)cn2n1
InChIInChI=1S/C10H12N4O2/c1-6(2)11-8-3-4-9-12-7(10(15)16)5-14(9)13-8/h3-6H,1-2H3,(H,11,13)(H,15,16)
InChIKeyUBZSQUQOAOIHMP-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.25
Rot. Bonds3

About 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid

6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid (PubChem CID 84685599) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid.

Molecular Properties

Compound Name6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid
PubChem CID84685599
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid
SMILESCC(C)Nc1ccc2nc(C(=O)O)cn2n1
InChIInChI=1S/C10H12N4O2/c1-6(2)11-8-3-4-9-12-7(10(15)16)5-14(9)13-8/h3-6H,1-2H3,(H,11,13)(H,15,16)
InChIKeyUBZSQUQOAOIHMP-UHFFFAOYSA-N
XLogP1.25
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The IUPAC name of 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid (CID 84685599) is 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid.
What is the SMILES notation for 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The canonical SMILES for 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid is CC(C)Nc1ccc2nc(C(=O)O)cn2n1.
What is the InChIKey of 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid?
The InChIKey is UBZSQUQOAOIHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6(2)11-8-3-4-9-12-7(10(15)16)5-14(9)13-8/h3-6H,1-2H3,(H,11,13)(H,15,16).
What are the key properties of 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid?
6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid has a molecular weight of 220.23 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(propan-2-ylamino)imidazo[1,2-b]pyridazine-2-carboxylic acid is sourced from PubChem (CID 84685599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).