8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine

C21H23FN6 — CID 170593680

IUPAC8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine
SMILESCCc1cc(-c2cc(F)c3nc(C4CCNCC4)cn3c2)nn2cc(C)nc12
InChIInChI=1S/C21H23FN6/c1-3-14-9-18(26-28-10-13(2)24-20(14)28)16-8-17(22)21-25-19(12-27(21)11-16)15-4-6-23-7-5-15/h8-12,15,23H,3-7H2,1-2H3
InChIKeyJRYHDSOZZVDHMB-UHFFFAOYSA-N
MW378.46 g/mol
LogP3.52
Rot. Bonds3

About 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine

8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine (PubChem CID 170593680) has the molecular formula C21H23FN6 and a molecular weight of 378.46 g/mol. Its IUPAC name is 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine
PubChem CID170593680
Molecular FormulaC21H23FN6
Molecular Weight378.46 g/mol
Exact Mass378.20
IUPAC Name8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine
SMILESCCc1cc(-c2cc(F)c3nc(C4CCNCC4)cn3c2)nn2cc(C)nc12
InChIInChI=1S/C21H23FN6/c1-3-14-9-18(26-28-10-13(2)24-20(14)28)16-8-17(22)21-25-19(12-27(21)11-16)15-4-6-23-7-5-15/h8-12,15,23H,3-7H2,1-2H3
InChIKeyJRYHDSOZZVDHMB-UHFFFAOYSA-N
XLogP3.52
TPSA59.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(8-fluoro-2-pyrrolidin-3-ylimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593872
6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170340773
6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593629
6-[8-fluoro-2-[1-(3-methoxypropyl)piperidin-4-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593597
6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoro-2-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyridine;2-methylpropane
CID 170593728
2-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 170593746
6-[8-fluoro-2-[1-(oxolan-3-yl)piperidin-4-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593502
methyl 2-[6-(4-fluoro-2-piperidin-4-yl-1,3-benzothiazol-6-yl)-2-methylimidazo[1,2-b]pyridazin-8-yl]acetate;hydrochloride
CID 153383568
6-[8-fluoro-2-[(1S,5R)-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]imidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
CID 170593790
6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-4-fluoro-2-piperidin-4-yl-1,3-benzothiazole;hydrochloride
CID 153383064
6-(2,8-dimethylimidazo[1,2-b]pyridazin-6-yl)-8-fluoro-N-[[(2R)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 170340784
6-(4-fluoro-2-piperidin-4-yl-1,3-benzothiazol-6-yl)-N,N,2-trimethylimidazo[1,2-b]pyridazin-8-amine;hydrochloride
CID 153383206

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine?
The IUPAC name of 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine (CID 170593680) is 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine?
The canonical SMILES for 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine is CCc1cc(-c2cc(F)c3nc(C4CCNCC4)cn3c2)nn2cc(C)nc12.
What is the InChIKey of 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine?
The InChIKey is JRYHDSOZZVDHMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23FN6/c1-3-14-9-18(26-28-10-13(2)24-20(14)28)16-8-17(22)21-25-19(12-27(21)11-16)15-4-6-23-7-5-15/h8-12,15,23H,3-7H2,1-2H3.
What are the key properties of 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine?
8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine has a molecular weight of 378.46 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6-(8-fluoro-2-piperidin-4-ylimidazo[1,2-a]pyridin-6-yl)-2-methylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 170593680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).