6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine

C13H9F2N3O — CID 116854306

IUPAC6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCOc1cc(F)c(-c2ccc3nccn3n2)cc1F
InChIInChI=1S/C13H9F2N3O/c1-19-12-7-9(14)8(6-10(12)15)11-2-3-13-16-4-5-18(13)17-11/h2-7H,1H3
InChIKeyLWNSOPVNSGMWLP-UHFFFAOYSA-N
MW261.23 g/mol
LogP2.68
Rot. Bonds2

About 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine

6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine (PubChem CID 116854306) has the molecular formula C13H9F2N3O and a molecular weight of 261.23 g/mol. Its IUPAC name is 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine
PubChem CID116854306
Molecular FormulaC13H9F2N3O
Molecular Weight261.23 g/mol
Exact Mass261.07
IUPAC Name6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine
SMILESCOc1cc(F)c(-c2ccc3nccn3n2)cc1F
InChIInChI=1S/C13H9F2N3O/c1-19-12-7-9(14)8(6-10(12)15)11-2-3-13-16-4-5-18(13)17-11/h2-7H,1H3
InChIKeyLWNSOPVNSGMWLP-UHFFFAOYSA-N
XLogP2.68
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.23
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine (CID 116854306) is 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine is COc1cc(F)c(-c2ccc3nccn3n2)cc1F.
What is the InChIKey of 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine?
The InChIKey is LWNSOPVNSGMWLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N3O/c1-19-12-7-9(14)8(6-10(12)15)11-2-3-13-16-4-5-18(13)17-11/h2-7H,1H3.
What are the key properties of 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine?
6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine has a molecular weight of 261.23 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-difluoro-4-methoxyphenyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 116854306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).