6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

C17H13N5O — CID 90670256

IUPAC6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCOc1ccc(-c2ccc3ncc(-c4ccncc4)n3n2)cn1
InChIInChI=1S/C17H13N5O/c1-23-17-5-2-13(10-20-17)14-3-4-16-19-11-15(22(16)21-14)12-6-8-18-9-7-12/h2-11H,1H3
InChIKeyJNTAONNXQRTFEP-UHFFFAOYSA-N
MW303.33 g/mol
LogP2.86
Rot. Bonds3

About 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine

6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (PubChem CID 90670256) has the molecular formula C17H13N5O and a molecular weight of 303.33 g/mol. Its IUPAC name is 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
PubChem CID90670256
Molecular FormulaC17H13N5O
Molecular Weight303.33 g/mol
Exact Mass303.11
IUPAC Name6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine
SMILESCOc1ccc(-c2ccc3ncc(-c4ccncc4)n3n2)cn1
InChIInChI=1S/C17H13N5O/c1-23-17-5-2-13(10-20-17)14-3-4-16-19-11-15(22(16)21-14)12-6-8-18-9-7-12/h2-11H,1H3
InChIKeyJNTAONNXQRTFEP-UHFFFAOYSA-N
XLogP2.86
TPSA65.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine (CID 90670256) is 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is COc1ccc(-c2ccc3ncc(-c4ccncc4)n3n2)cn1.
What is the InChIKey of 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
The InChIKey is JNTAONNXQRTFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O/c1-23-17-5-2-13(10-20-17)14-3-4-16-19-11-15(22(16)21-14)12-6-8-18-9-7-12/h2-11H,1H3.
What are the key properties of 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine?
6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine has a molecular weight of 303.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methoxy-3-pyridinyl)-3-pyridin-4-ylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 90670256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).