3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine

C14H13N3O — CID 46944150

IUPAC3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCCOc1cccc(-c2cnc3cccnn23)c1
InChIInChI=1S/C14H13N3O/c1-2-18-12-6-3-5-11(9-12)13-10-15-14-7-4-8-16-17(13)14/h3-10H,2H2,1H3
InChIKeyPDFZSGXEBZJDIM-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.80
Rot. Bonds3

About 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine

3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine (PubChem CID 46944150) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine
PubChem CID46944150
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCCOc1cccc(-c2cnc3cccnn23)c1
InChIInChI=1S/C14H13N3O/c1-2-18-12-6-3-5-11(9-12)13-10-15-14-7-4-8-16-17(13)14/h3-10H,2H2,1H3
InChIKeyPDFZSGXEBZJDIM-UHFFFAOYSA-N
XLogP2.80
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Taletrectinib
CID 72202474
Mak-683
CID 121412508
N-[(1-methylpiperidin-4-yl)methyl]-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-amine
CID 24795070
Sch 28080
CID 108137
7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
2-(4-Ethoxyphenyl)imidazo[1,2-a]pyridine
CID 720519
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
US10399985, Example 36
CID 118288233
US10399985, Example 45
CID 122693993
2-[4-[3-(Azepan-1-yl)propoxy]-2-methylphenyl]-7-methylimidazo[1,2-a]pyridine
CID 22390950
3-(4-ethoxyphenyl)-N-[(4-ethylphenyl)methyl]triazolo[4,5-b]pyridin-6-amine
CID 42602774

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine (CID 46944150) is 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine is CCOc1cccc(-c2cnc3cccnn23)c1.
What is the InChIKey of 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine?
The InChIKey is PDFZSGXEBZJDIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-2-18-12-6-3-5-11(9-12)13-10-15-14-7-4-8-16-17(13)14/h3-10H,2H2,1H3.
What are the key properties of 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine?
3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine has a molecular weight of 239.28 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethoxyphenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 46944150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).