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

C17H13N3O2 — CID 155540937

IUPAC[4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol
SMILESOCc1ccc(-c2cnc3ccc(-c4ccoc4)nn23)cc1
InChIInChI=1S/C17H13N3O2/c21-10-12-1-3-13(4-2-12)16-9-18-17-6-5-15(19-20(16)17)14-7-8-22-11-14/h1-9,11,21H,10H2
InChIKeyCXMIHICNJYYSIF-UHFFFAOYSA-N
MW291.31 g/mol
LogP3.15
Rot. Bonds3

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

[4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol (PubChem CID 155540937) has the molecular formula C17H13N3O2 and a molecular weight of 291.31 g/mol. Its IUPAC name is [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol
PubChem CID155540937
Molecular FormulaC17H13N3O2
Molecular Weight291.31 g/mol
Exact Mass291.10
IUPAC Name[4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol
SMILESOCc1ccc(-c2cnc3ccc(-c4ccoc4)nn23)cc1
InChIInChI=1S/C17H13N3O2/c21-10-12-1-3-13(4-2-12)16-9-18-17-6-5-15(19-20(16)17)14-7-8-22-11-14/h1-9,11,21H,10H2
InChIKeyCXMIHICNJYYSIF-UHFFFAOYSA-N
XLogP3.15
TPSA63.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol?
The IUPAC name of [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol (CID 155540937) is [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol.
What is the SMILES notation for [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol?
The canonical SMILES for [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol is OCc1ccc(-c2cnc3ccc(-c4ccoc4)nn23)cc1.
What is the InChIKey of [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol?
The InChIKey is CXMIHICNJYYSIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O2/c21-10-12-1-3-13(4-2-12)16-9-18-17-6-5-15(19-20(16)17)14-7-8-22-11-14/h1-9,11,21H,10H2.
What are the key properties of [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol?
[4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol has a molecular weight of 291.31 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(furan-3-yl)imidazo[1,2-b]pyridazin-3-yl]phenyl]methanol is sourced from PubChem (CID 155540937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).