2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde

C11H11N3O — CID 143347877

IUPAC2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde
SMILESCc1ccc2nc(C3CC3)c(C=O)n2n1
InChIInChI=1S/C11H11N3O/c1-7-2-5-10-12-11(8-3-4-8)9(6-15)14(10)13-7/h2,5-6,8H,3-4H2,1H3
InChIKeyABQXUZXXNCMBFZ-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.73
Rot. Bonds2

About 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde

2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde (PubChem CID 143347877) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde.

Molecular Properties

Compound Name2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde
PubChem CID143347877
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde
SMILESCc1ccc2nc(C3CC3)c(C=O)n2n1
InChIInChI=1S/C11H11N3O/c1-7-2-5-10-12-11(8-3-4-8)9(6-15)14(10)13-7/h2,5-6,8H,3-4H2,1H3
InChIKeyABQXUZXXNCMBFZ-UHFFFAOYSA-N
XLogP1.73
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde?
The IUPAC name of 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde (CID 143347877) is 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde.
What is the SMILES notation for 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde?
The canonical SMILES for 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde is Cc1ccc2nc(C3CC3)c(C=O)n2n1.
What is the InChIKey of 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde?
The InChIKey is ABQXUZXXNCMBFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-7-2-5-10-12-11(8-3-4-8)9(6-15)14(10)13-7/h2,5-6,8H,3-4H2,1H3.
What are the key properties of 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde?
2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde has a molecular weight of 201.23 g/mol, XLogP of 1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-methylimidazo[1,2-b]pyridazine-3-carbaldehyde is sourced from PubChem (CID 143347877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).