2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine

C24H24FN7 — CID 25226991

IUPAC2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine
SMILESFc1ccc(-c2nc3ccc(N4CCC(N5CCCC5)C4)nn3c2-c2ccnnc2)cc1
InChIInChI=1S/C24H24FN7/c25-19-5-3-17(4-6-19)23-24(18-9-11-26-27-15-18)32-21(28-23)7-8-22(29-32)31-14-10-20(16-31)30-12-1-2-13-30/h3-9,11,15,20H,1-2,10,12-14,16H2
InChIKeyKSOKOIASIGSSLV-UHFFFAOYSA-N
MW429.50 g/mol
LogP3.67
Rot. Bonds4

About 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine

2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine (PubChem CID 25226991) has the molecular formula C24H24FN7 and a molecular weight of 429.50 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine
PubChem CID25226991
Molecular FormulaC24H24FN7
Molecular Weight429.50 g/mol
Exact Mass429.21
IUPAC Name2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine
SMILESFc1ccc(-c2nc3ccc(N4CCC(N5CCCC5)C4)nn3c2-c2ccnnc2)cc1
InChIInChI=1S/C24H24FN7/c25-19-5-3-17(4-6-19)23-24(18-9-11-26-27-15-18)32-21(28-23)7-8-22(29-32)31-14-10-20(16-31)30-12-1-2-13-30/h3-9,11,15,20H,1-2,10,12-14,16H2
InChIKeyKSOKOIASIGSSLV-UHFFFAOYSA-N
XLogP3.67
TPSA62.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.50
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

6-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-(4-fluorophenyl)-3-pyridazin-4-ylimidazo[1,2-b]pyridazine
CID 91220235
6-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-2-(4-fluorophenyl)-3-pyridazin-4-ylimidazo[1,2-b]pyridazine
CID 25226802
1-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]-N,N-dimethylpyrrolidin-3-amine
CID 25144809
2-(4-fluorophenyl)-6-[(3S)-3-methylpiperazin-1-yl]-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 25143825
2-[5-[2-(4-fluorophenyl)-3-pyridazin-4-ylimidazo[1,2-b]pyridazin-6-yl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethanol
CID 25227356
3-[3-pyridin-4-yl-6-(4-pyrrolidin-1-ylpiperidin-1-yl)imidazo[1,2-b]pyridazin-2-yl]phenol
CID 155512835
6-(3,4,8,8a-tetrahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-(4-fluorophenyl)-3-(2-methoxy-4-pyridinyl)imidazo[1,2-b]pyridazine
CID 90978764
2-[4-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]piperazin-2-yl]propan-2-ol
CID 68516909
[4-[6-(1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl)-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]methanamine
CID 68517903
6-(2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl)-2-(4-fluorophenyl)-3-(2-methoxy-4-pyridinyl)imidazo[1,2-b]pyridazine
CID 68519598
1-[4-[2-(4-fluorophenyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazin-6-yl]piperazin-1-yl]-2-methylpropan-2-ol
CID 25145504
11-[2-(4-fluorophenyl)-3-pyridazin-4-ylimidazo[1,2-b]pyridazin-6-yl]-2,9-diazaspiro[5.5]undecane
CID 91434387

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The IUPAC name of 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine (CID 25226991) is 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine is Fc1ccc(-c2nc3ccc(N4CCC(N5CCCC5)C4)nn3c2-c2ccnnc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
The InChIKey is KSOKOIASIGSSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN7/c25-19-5-3-17(4-6-19)23-24(18-9-11-26-27-15-18)32-21(28-23)7-8-22(29-32)31-14-10-20(16-31)30-12-1-2-13-30/h3-9,11,15,20H,1-2,10,12-14,16H2.
What are the key properties of 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine?
2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine has a molecular weight of 429.50 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-pyridazin-4-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 25226991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).