6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine

C12H9ClN4O — CID 58857859

IUPAC6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine
SMILESCOc1ccc(-c2cnc3ccc(Cl)nn23)cn1
InChIInChI=1S/C12H9ClN4O/c1-18-12-5-2-8(6-15-12)9-7-14-11-4-3-10(13)16-17(9)11/h2-7H,1H3
InChIKeyASTIAIOSNQDGTH-UHFFFAOYSA-N
MW260.68 g/mol
LogP2.45
Rot. Bonds2

About 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine

6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine (PubChem CID 58857859) has the molecular formula C12H9ClN4O and a molecular weight of 260.68 g/mol. Its IUPAC name is 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine
PubChem CID58857859
Molecular FormulaC12H9ClN4O
Molecular Weight260.68 g/mol
Exact Mass260.05
IUPAC Name6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine
SMILESCOc1ccc(-c2cnc3ccc(Cl)nn23)cn1
InChIInChI=1S/C12H9ClN4O/c1-18-12-5-2-8(6-15-12)9-7-14-11-4-3-10(13)16-17(9)11/h2-7H,1H3
InChIKeyASTIAIOSNQDGTH-UHFFFAOYSA-N
XLogP2.45
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.68
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine (CID 58857859) is 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine is COc1ccc(-c2cnc3ccc(Cl)nn23)cn1.
What is the InChIKey of 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine?
The InChIKey is ASTIAIOSNQDGTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN4O/c1-18-12-5-2-8(6-15-12)9-7-14-11-4-3-10(13)16-17(9)11/h2-7H,1H3.
What are the key properties of 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine?
6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine has a molecular weight of 260.68 g/mol, XLogP of 2.45, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 58857859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).