2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

C24H25FN6 — CID 25145367

IUPAC2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCC(C)N1CCN(c2ccc3nc(-c4cccc(F)c4)c(-c4ccncc4)n3n2)CC1
InChIInChI=1S/C24H25FN6/c1-17(2)29-12-14-30(15-13-29)22-7-6-21-27-23(19-4-3-5-20(25)16-19)24(31(21)28-22)18-8-10-26-11-9-18/h3-11,16-17H,12-15H2,1-2H3
InChIKeyGESPSFZCWBJEOE-UHFFFAOYSA-N
MW416.50 g/mol
LogP4.13
Rot. Bonds4

About 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (PubChem CID 25145367) has the molecular formula C24H25FN6 and a molecular weight of 416.50 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
PubChem CID25145367
Molecular FormulaC24H25FN6
Molecular Weight416.50 g/mol
Exact Mass416.21
IUPAC Name2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCC(C)N1CCN(c2ccc3nc(-c4cccc(F)c4)c(-c4ccncc4)n3n2)CC1
InChIInChI=1S/C24H25FN6/c1-17(2)29-12-14-30(15-13-29)22-7-6-21-27-23(19-4-3-5-20(25)16-19)24(31(21)28-22)18-8-10-26-11-9-18/h3-11,16-17H,12-15H2,1-2H3
InChIKeyGESPSFZCWBJEOE-UHFFFAOYSA-N
XLogP4.13
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.50
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-fluorophenyl)-6-(3-methylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 68517521
2-(3,5-difluorophenyl)-6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 25144234
1-[4-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]piperazin-1-yl]-2-methylpropan-2-ol
CID 25145504
3-[3-pyridin-4-yl-6-(4-pyrrolidin-1-ylpiperidin-1-yl)imidazo[1,2-b]pyridazin-2-yl]phenol
CID 155512835
2-(4-fluorophenyl)-6-[(3S)-3-methylpiperazin-1-yl]-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 25143825
6-piperidin-1-yl-3-pyridin-4-yl-2-thiophen-2-ylimidazo[1,2-b]pyridazine
CID 46197475
1-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylpyrrolidin-3-amine
CID 25144809
6-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-2-phenyl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 68514785
2-[4-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]piperazin-2-yl]propan-2-ol
CID 68516909
2-(cyclobutadienyl)-6-piperazin-1-yl-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 66698021
2-(4-fluorophenyl)-6-(4-methylpiperazin-1-yl)-3-pyrimidin-4-ylimidazo[1,2-b]pyridazine
CID 46197357
2-methyl-1-[4-(3-pyridin-4-yl-2-thiophen-3-ylimidazo[1,2-b]pyridazin-6-yl)piperazin-1-yl]propan-2-ol
CID 46836319

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (CID 25145367) is 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is CC(C)N1CCN(c2ccc3nc(-c4cccc(F)c4)c(-c4ccncc4)n3n2)CC1.
What is the InChIKey of 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The InChIKey is GESPSFZCWBJEOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN6/c1-17(2)29-12-14-30(15-13-29)22-7-6-21-27-23(19-4-3-5-20(25)16-19)24(31(21)28-22)18-8-10-26-11-9-18/h3-11,16-17H,12-15H2,1-2H3.
What are the key properties of 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine has a molecular weight of 416.50 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-6-(4-propan-2-ylpiperazin-1-yl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 25145367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).