[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol

C18H14N4O — CID 126672938

IUPAC[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
SMILESOCc1cccc(-c2cnc3ccc(-c4ccncc4)nn23)c1
InChIInChI=1S/C18H14N4O/c23-12-13-2-1-3-15(10-13)17-11-20-18-5-4-16(21-22(17)18)14-6-8-19-9-7-14/h1-11,23H,12H2
InChIKeyARCYVGBSXYJFRO-UHFFFAOYSA-N
MW302.34 g/mol
LogP2.95
Rot. Bonds3

About [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol

[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol (PubChem CID 126672938) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
PubChem CID126672938
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol
SMILESOCc1cccc(-c2cnc3ccc(-c4ccncc4)nn23)c1
InChIInChI=1S/C18H14N4O/c23-12-13-2-1-3-15(10-13)17-11-20-18-5-4-16(21-22(17)18)14-6-8-19-9-7-14/h1-11,23H,12H2
InChIKeyARCYVGBSXYJFRO-UHFFFAOYSA-N
XLogP2.95
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The IUPAC name of [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol (CID 126672938) is [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol.
What is the SMILES notation for [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The canonical SMILES for [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol is OCc1cccc(-c2cnc3ccc(-c4ccncc4)nn23)c1.
What is the InChIKey of [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
The InChIKey is ARCYVGBSXYJFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c23-12-13-2-1-3-15(10-13)17-11-20-18-5-4-16(21-22(17)18)14-6-8-19-9-7-14/h1-11,23H,12H2.
What are the key properties of [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol?
[3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol has a molecular weight of 302.34 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6-pyridin-4-ylimidazo[1,2-b]pyridazin-3-yl)phenyl]methanol is sourced from PubChem (CID 126672938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).