2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine

C13H9F2N3 — CID 70987260

IUPAC2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine
SMILESCc1ccc2nc(-c3cc(F)cc(F)c3)cn2n1
InChIInChI=1S/C13H9F2N3/c1-8-2-3-13-16-12(7-18(13)17-8)9-4-10(14)6-11(15)5-9/h2-7H,1H3
InChIKeyXXCJCZIZONRGRO-UHFFFAOYSA-N
MW245.23 g/mol
LogP2.98
Rot. Bonds1

About 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine

2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine (PubChem CID 70987260) has the molecular formula C13H9F2N3 and a molecular weight of 245.23 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine
PubChem CID70987260
Molecular FormulaC13H9F2N3
Molecular Weight245.23 g/mol
Exact Mass245.08
IUPAC Name2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine
SMILESCc1ccc2nc(-c3cc(F)cc(F)c3)cn2n1
InChIInChI=1S/C13H9F2N3/c1-8-2-3-13-16-12(7-18(13)17-8)9-4-10(14)6-11(15)5-9/h2-7H,1H3
InChIKeyXXCJCZIZONRGRO-UHFFFAOYSA-N
XLogP2.98
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine (CID 70987260) is 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine is Cc1ccc2nc(-c3cc(F)cc(F)c3)cn2n1.
What is the InChIKey of 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine?
The InChIKey is XXCJCZIZONRGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N3/c1-8-2-3-13-16-12(7-18(13)17-8)9-4-10(14)6-11(15)5-9/h2-7H,1H3.
What are the key properties of 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine?
2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine has a molecular weight of 245.23 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-6-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 70987260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).