6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine

C21H19FN6O — CID 134806032

IUPAC6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine
SMILESFc1ccc(-c2ccc3ncc(Nc4ccnc(N5CCOCC5)c4)n3n2)cc1
InChIInChI=1S/C21H19FN6O/c22-16-3-1-15(2-4-16)18-5-6-19-24-14-21(28(19)26-18)25-17-7-8-23-20(13-17)27-9-11-29-12-10-27/h1-8,13-14H,9-12H2,(H,23,25)
InChIKeyIKHGGMQFUKWFGZ-UHFFFAOYSA-N
MW390.42 g/mol
LogP3.51
Rot. Bonds4

About 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine

6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine (PubChem CID 134806032) has the molecular formula C21H19FN6O and a molecular weight of 390.42 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine
PubChem CID134806032
Molecular FormulaC21H19FN6O
Molecular Weight390.42 g/mol
Exact Mass390.16
IUPAC Name6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine
SMILESFc1ccc(-c2ccc3ncc(Nc4ccnc(N5CCOCC5)c4)n3n2)cc1
InChIInChI=1S/C21H19FN6O/c22-16-3-1-15(2-4-16)18-5-6-19-24-14-21(28(19)26-18)25-17-7-8-23-20(13-17)27-9-11-29-12-10-27/h1-8,13-14H,9-12H2,(H,23,25)
InChIKeyIKHGGMQFUKWFGZ-UHFFFAOYSA-N
XLogP3.51
TPSA67.58 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.42
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine?
The IUPAC name of 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine (CID 134806032) is 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine?
The canonical SMILES for 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine is Fc1ccc(-c2ccc3ncc(Nc4ccnc(N5CCOCC5)c4)n3n2)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine?
The InChIKey is IKHGGMQFUKWFGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19FN6O/c22-16-3-1-15(2-4-16)18-5-6-19-24-14-21(28(19)26-18)25-17-7-8-23-20(13-17)27-9-11-29-12-10-27/h1-8,13-14H,9-12H2,(H,23,25).
What are the key properties of 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine?
6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine has a molecular weight of 390.42 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-N-(2-morpholin-4-yl-4-pyridinyl)imidazo[1,2-b]pyridazin-3-amine is sourced from PubChem (CID 134806032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).