2-phenyl-6-propoxyimidazo[1,2-b]pyridazine

C15H15N3O — CID 10658538

IUPAC2-phenyl-6-propoxyimidazo[1,2-b]pyridazine
SMILESCCCOc1ccc2nc(-c3ccccc3)cn2n1
InChIInChI=1S/C15H15N3O/c1-2-10-19-15-9-8-14-16-13(11-18(14)17-15)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3
InChIKeyHKQLCVAVBFZWLQ-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.19
Rot. Bonds4

About 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine

2-phenyl-6-propoxyimidazo[1,2-b]pyridazine (PubChem CID 10658538) has the molecular formula C15H15N3O and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2-phenyl-6-propoxyimidazo[1,2-b]pyridazine
PubChem CID10658538
Molecular FormulaC15H15N3O
Molecular Weight253.30 g/mol
Exact Mass253.12
IUPAC Name2-phenyl-6-propoxyimidazo[1,2-b]pyridazine
SMILESCCCOc1ccc2nc(-c3ccccc3)cn2n1
InChIInChI=1S/C15H15N3O/c1-2-10-19-15-9-8-14-16-13(11-18(14)17-15)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3
InChIKeyHKQLCVAVBFZWLQ-UHFFFAOYSA-N
XLogP3.19
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine?
The IUPAC name of 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine (CID 10658538) is 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine.
What is the SMILES notation for 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine?
The canonical SMILES for 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine is CCCOc1ccc2nc(-c3ccccc3)cn2n1.
What is the InChIKey of 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine?
The InChIKey is HKQLCVAVBFZWLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-2-10-19-15-9-8-14-16-13(11-18(14)17-15)12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3.
What are the key properties of 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine?
2-phenyl-6-propoxyimidazo[1,2-b]pyridazine has a molecular weight of 253.30 g/mol, XLogP of 3.19, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-propoxyimidazo[1,2-b]pyridazine is sourced from PubChem (CID 10658538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).