4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine

C23H28N4O2 — CID 68819375

About 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine

4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine (PubChem CID 68819375) has the molecular formula C23H28N4O2 and a molecular weight of 392.50 g/mol. Its IUPAC name is 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine.

Molecular Properties

• Compound Name: 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine
• PubChem CID: 68819375
• Molecular Formula: C23H28N4O2
• Molecular Weight: 392.50 g/mol
• Exact Mass: 392.22
• IUPAC Name: 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine
• SMILES: CCN(CC)CCCC(C)Oc1ccc2nc(-c3cc4ccccc4o3)cn2n1
• InChI: InChI=1S/C23H28N4O2/c1-4-26(5-2)14-8-9-17(3)28-23-13-12-22-24-19(16-27(22)25-23)21-15-18-10-6-7-11-20(18)29-21/h6-7,10-13,15-17H,4-5,8-9,14H2,1-3H3
• InChIKey: ONVDICMSFDXXDC-UHFFFAOYSA-N
• XLogP: 5.03
• TPSA: 55.80 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 9
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	392.50
LogP ≤ 5	5.03
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine?

The IUPAC name of 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine (CID 68819375) is 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine.

What is the SMILES notation for 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine?

The canonical SMILES for 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine is CCN(CC)CCCC(C)Oc1ccc2nc(-c3cc4ccccc4o3)cn2n1.

What is the InChIKey of 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine?

The InChIKey is ONVDICMSFDXXDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N4O2/c1-4-26(5-2)14-8-9-17(3)28-23-13-12-22-24-19(16-27(22)25-23)21-15-18-10-6-7-11-20(18)29-21/h6-7,10-13,15-17H,4-5,8-9,14H2,1-3H3.

What are the key properties of 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine?

4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine has a molecular weight of 392.50 g/mol, XLogP of 5.03, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxy-N,N-diethylpentan-1-amine is sourced from PubChem (CID 68819375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).