8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine

C13H9F3N4 — CID 135284836

IUPAC8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine
SMILESCc1cn2nccc(-c3ccc(F)c(C(F)F)n3)c2n1
InChIInChI=1S/C13H9F3N4/c1-7-6-20-13(18-7)8(4-5-17-20)10-3-2-9(14)11(19-10)12(15)16/h2-6,12H,1H3
InChIKeyCDZHOMSAQFLEHQ-UHFFFAOYSA-N
MW278.24 g/mol
LogP3.18
Rot. Bonds2

About 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine

8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine (PubChem CID 135284836) has the molecular formula C13H9F3N4 and a molecular weight of 278.24 g/mol. Its IUPAC name is 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine
PubChem CID135284836
Molecular FormulaC13H9F3N4
Molecular Weight278.24 g/mol
Exact Mass278.08
IUPAC Name8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine
SMILESCc1cn2nccc(-c3ccc(F)c(C(F)F)n3)c2n1
InChIInChI=1S/C13H9F3N4/c1-7-6-20-13(18-7)8(4-5-17-20)10-3-2-9(14)11(19-10)12(15)16/h2-6,12H,1H3
InChIKeyCDZHOMSAQFLEHQ-UHFFFAOYSA-N
XLogP3.18
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.24
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dimethyl-1-[[2-methyl-6-(2-methylimidazo[1,2-b]pyridazin-8-yl)-3-pyridinyl]oxy]pentan-2-amine
CID 137459453
N-ethyl-N,2-dimethylimidazo[1,2-b]pyridazin-8-amine
CID 123980916
6-(1-cyclobutyl-3-cyclopropylpyrazol-4-yl)-2-(difluoromethyl)-3-fluoropyridine
CID 176718343
5-[2-(5-fluoro-6-methyl-2-pyridinyl)-3-pyridinyl]pyrazolo[1,5-a]pyrimidine
CID 122478589
6-bromo-8-fluoro-2-methylimidazo[1,2-b]pyridazine
CID 177071326
6-tert-butyl-2-(difluoromethyl)-3-fluoropyridine
CID 155443837
6-[2-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine
CID 140738843
2-(difluoromethyl)-3,6-dimethylpyridine
CID 121232017
3-(6-chloropyrimidin-4-yl)-5-(difluoromethyl)-6-fluoro-2-methylpyrazolo[1,5-a]pyrimidine
CID 139358950
1-(3,4-difluorophenyl)-4-methylimidazol-2-amine
CID 106558202
8-fluoro-6-(2-fluorophenyl)-2-methylimidazo[1,2-a]pyridine
CID 175581165
2-(difluoromethyl)-3,6-difluoro-5-methylpyridine
CID 130099696

Frequently Asked Questions

What is the IUPAC name of 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine (CID 135284836) is 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine is Cc1cn2nccc(-c3ccc(F)c(C(F)F)n3)c2n1.
What is the InChIKey of 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is CDZHOMSAQFLEHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3N4/c1-7-6-20-13(18-7)8(4-5-17-20)10-3-2-9(14)11(19-10)12(15)16/h2-6,12H,1H3.
What are the key properties of 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine?
8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 278.24 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-(difluoromethyl)-5-fluoro-2-pyridinyl]-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 135284836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).