4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane

C19H17ClFN5 — CID 143254997

IUPAC4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane
SMILESCC.Nc1cc(-c2c(-c3ccc(F)cc3)nc3ccc(Cl)nn23)ccn1
InChIInChI=1S/C17H11ClFN5.C2H6/c18-13-5-6-15-22-16(10-1-3-12(19)4-2-10)17(24(15)23-13)11-7-8-21-14(20)9-11;1-2/h1-9H,(H2,20,21);1-2H3
InChIKeyRCRZTFTYZOCYKT-UHFFFAOYSA-N
MW369.83 g/mol
LogP4.86
Rot. Bonds2

About 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane

4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane (PubChem CID 143254997) has the molecular formula C19H17ClFN5 and a molecular weight of 369.83 g/mol. Its IUPAC name is 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane.

Molecular Properties

Compound Name4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane
PubChem CID143254997
Molecular FormulaC19H17ClFN5
Molecular Weight369.83 g/mol
Exact Mass369.12
IUPAC Name4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane
SMILESCC.Nc1cc(-c2c(-c3ccc(F)cc3)nc3ccc(Cl)nn23)ccn1
InChIInChI=1S/C17H11ClFN5.C2H6/c18-13-5-6-15-22-16(10-1-3-12(19)4-2-10)17(24(15)23-13)11-7-8-21-14(20)9-11;1-2/h1-9H,(H2,20,21);1-2H3
InChIKeyRCRZTFTYZOCYKT-UHFFFAOYSA-N
XLogP4.86
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.83
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[7-tert-butyl-6-chloro-2-(4-fluoro-3-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine
CID 59759521
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
4-[6-chloro-2-(3-methylphenyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-2-amine
CID 59759615
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-(2-methoxy-4-pyridinyl)imidazo[1,2-b]pyridazin-6-yl]piperazin-1-yl]ethanol
CID 25181723
2-(4-fluorophenyl)-6-[(3S)-3-methylpiperazin-1-yl]-3-pyridin-4-ylimidazo[1,2-b]pyridazine
CID 25143825
8-(2-amino-4-pyridinyl)-9-ethyl-6-(4-fluorophenyl)purin-2-amine
CID 142780240
[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
2-chloro-4-[1-(4-fluorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]pyridine;4-[1-(4-fluorophenyl)-3-(trifluoromethyl)pyrazol-5-yl]pyridin-2-amine
CID 158641773
4-[3-(4-fluorophenyl)-1-[3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]pyrazol-4-yl]pyridin-2-amine
CID 10048870
[6-chloro-2-(4-chlorophenyl)imidazo[1,2-b]pyridazin-3-yl]methyl-trimethylazanium iodide
CID 10623951
4-[2-[4-[(4-fluorophenyl)methoxy]phenyl]imidazo[1,2-a]pyrimidin-3-yl]pyridin-2-amine
CID 142578098

Frequently Asked Questions

What is the IUPAC name of 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane?
The IUPAC name of 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane (CID 143254997) is 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane.
What is the SMILES notation for 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane?
The canonical SMILES for 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane is CC.Nc1cc(-c2c(-c3ccc(F)cc3)nc3ccc(Cl)nn23)ccn1.
What is the InChIKey of 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane?
The InChIKey is RCRZTFTYZOCYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClFN5.C2H6/c18-13-5-6-15-22-16(10-1-3-12(19)4-2-10)17(24(15)23-13)11-7-8-21-14(20)9-11;1-2/h1-9H,(H2,20,21);1-2H3.
What are the key properties of 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane?
4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane has a molecular weight of 369.83 g/mol, XLogP of 4.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazin-3-yl]pyridin-2-amine;ethane is sourced from PubChem (CID 143254997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).