6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine

C14H12FN3O — CID 116854261

IUPAC6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine
SMILESCCOc1ccc(-c2ccc3nccn3n2)cc1F
InChIInChI=1S/C14H12FN3O/c1-2-19-13-5-3-10(9-11(13)15)12-4-6-14-16-7-8-18(14)17-12/h3-9H,2H2,1H3
InChIKeyBTOOZUCELKTSIJ-UHFFFAOYSA-N
MW257.27 g/mol
LogP2.93
Rot. Bonds3

About 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine

6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine (PubChem CID 116854261) has the molecular formula C14H12FN3O and a molecular weight of 257.27 g/mol. Its IUPAC name is 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine
PubChem CID116854261
Molecular FormulaC14H12FN3O
Molecular Weight257.27 g/mol
Exact Mass257.10
IUPAC Name6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine
SMILESCCOc1ccc(-c2ccc3nccn3n2)cc1F
InChIInChI=1S/C14H12FN3O/c1-2-19-13-5-3-10(9-11(13)15)12-4-6-14-16-7-8-18(14)17-12/h3-9H,2H2,1H3
InChIKeyBTOOZUCELKTSIJ-UHFFFAOYSA-N
XLogP2.93
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.27
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazine
CID 116854254
6-(3-ethyl-4-methoxyphenyl)imidazo[1,2-b]pyridazine
CID 116854258
6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine
CID 116854306
6-(3-bromo-4-methoxyphenyl)imidazo[1,2-b]pyridazine
CID 116854245
2-[4-(4-ethoxy-3-fluorophenyl)imidazol-1-yl]acetic acid
CID 82303646
6-[2-(2-fluorophenoxy)pyrimidin-5-yl]imidazo[1,2-b]pyridazine
CID 162507513
[4-(4-ethoxy-3-fluorophenyl)pyrimidin-2-yl]methanamine
CID 82479798
4-(4-ethoxy-3-fluorophenyl)-N,6-dimethylpyrimidin-2-amine
CID 116894641
1-[4-(4-ethoxy-3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylethanamine
CID 3616998
(1R)-N'-[6-(4-ethoxy-3-fluorophenyl)pyrimidin-4-yl]-1-phenylethane-1,2-diamine
CID 67967770
N-[(1R)-1-(4-ethoxy-3-fluorophenyl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 97132156
N-(4-ethoxy-3-fluorophenyl)-1-propan-2-ylimidazol-2-amine
CID 106579930

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine (CID 116854261) is 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine is CCOc1ccc(-c2ccc3nccn3n2)cc1F.
What is the InChIKey of 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine?
The InChIKey is BTOOZUCELKTSIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O/c1-2-19-13-5-3-10(9-11(13)15)12-4-6-14-16-7-8-18(14)17-12/h3-9H,2H2,1H3.
What are the key properties of 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine?
6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine has a molecular weight of 257.27 g/mol, XLogP of 2.93, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethoxy-3-fluorophenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 116854261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).