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

C13H9F2N3O — CID 67501940

IUPAC[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol
SMILESOCc1cnc2ccc(-c3ccc(F)c(F)c3)nn12
InChIInChI=1S/C13H9F2N3O/c14-10-2-1-8(5-11(10)15)12-3-4-13-16-6-9(7-19)18(13)17-12/h1-6,19H,7H2
InChIKeyWUELZODBUNSKHU-UHFFFAOYSA-N
MW261.23 g/mol
LogP2.17
Rot. Bonds2

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

[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol (PubChem CID 67501940) has the molecular formula C13H9F2N3O and a molecular weight of 261.23 g/mol. Its IUPAC name is [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol
PubChem CID67501940
Molecular FormulaC13H9F2N3O
Molecular Weight261.23 g/mol
Exact Mass261.07
IUPAC Name[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol
SMILESOCc1cnc2ccc(-c3ccc(F)c(F)c3)nn12
InChIInChI=1S/C13H9F2N3O/c14-10-2-1-8(5-11(10)15)12-3-4-13-16-6-9(7-19)18(13)17-12/h1-6,19H,7H2
InChIKeyWUELZODBUNSKHU-UHFFFAOYSA-N
XLogP2.17
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.23
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol?
The IUPAC name of [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol (CID 67501940) is [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol.
What is the SMILES notation for [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol?
The canonical SMILES for [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol is OCc1cnc2ccc(-c3ccc(F)c(F)c3)nn12.
What is the InChIKey of [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol?
The InChIKey is WUELZODBUNSKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N3O/c14-10-2-1-8(5-11(10)15)12-3-4-13-16-6-9(7-19)18(13)17-12/h1-6,19H,7H2.
What are the key properties of [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol?
[6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol has a molecular weight of 261.23 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,4-difluorophenyl)imidazo[1,2-b]pyridazin-3-yl]methanol is sourced from PubChem (CID 67501940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).