3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide

C19H14N4O2 — CID 57441068

IUPAC3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cccc(Oc2ccc3nccn3n2)c1
InChIInChI=1S/C19H14N4O2/c24-19(21-15-6-2-1-3-7-15)14-5-4-8-16(13-14)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24)
InChIKeyGIWGYHXKKYZEQA-UHFFFAOYSA-N
MW330.35 g/mol
LogP3.77
Rot. Bonds4

About 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide

3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide (PubChem CID 57441068) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide.

Molecular Properties

Compound Name3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide
PubChem CID57441068
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Name3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1cccc(Oc2ccc3nccn3n2)c1
InChIInChI=1S/C19H14N4O2/c24-19(21-15-6-2-1-3-7-15)14-5-4-8-16(13-14)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24)
InChIKeyGIWGYHXKKYZEQA-UHFFFAOYSA-N
XLogP3.77
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide?
The IUPAC name of 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide (CID 57441068) is 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide.
What is the SMILES notation for 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide?
The canonical SMILES for 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide is O=C(Nc1ccccc1)c1cccc(Oc2ccc3nccn3n2)c1.
What is the InChIKey of 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide?
The InChIKey is GIWGYHXKKYZEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c24-19(21-15-6-2-1-3-7-15)14-5-4-8-16(13-14)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24).
What are the key properties of 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide?
3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide has a molecular weight of 330.35 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazo[1,2-b]pyridazin-6-yloxy-N-phenylbenzamide is sourced from PubChem (CID 57441068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).