2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide

C20H16N4O2 — CID 118712384

IUPAC2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide
SMILESO=C(Cc1cccc(Oc2ccc3nccn3n2)c1)Nc1ccccc1
InChIInChI=1S/C20H16N4O2/c25-19(22-16-6-2-1-3-7-16)14-15-5-4-8-17(13-15)26-20-10-9-18-21-11-12-24(18)23-20/h1-13H,14H2,(H,22,25)
InChIKeyGBMZRUWTUJQDPZ-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.70
Rot. Bonds5

About 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide

2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide (PubChem CID 118712384) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide
PubChem CID118712384
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide
SMILESO=C(Cc1cccc(Oc2ccc3nccn3n2)c1)Nc1ccccc1
InChIInChI=1S/C20H16N4O2/c25-19(22-16-6-2-1-3-7-16)14-15-5-4-8-17(13-15)26-20-10-9-18-21-11-12-24(18)23-20/h1-13H,14H2,(H,22,25)
InChIKeyGBMZRUWTUJQDPZ-UHFFFAOYSA-N
XLogP3.70
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide?
The IUPAC name of 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide (CID 118712384) is 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide.
What is the SMILES notation for 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide?
The canonical SMILES for 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide is O=C(Cc1cccc(Oc2ccc3nccn3n2)c1)Nc1ccccc1.
What is the InChIKey of 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide?
The InChIKey is GBMZRUWTUJQDPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-19(22-16-6-2-1-3-7-16)14-15-5-4-8-17(13-15)26-20-10-9-18-21-11-12-24(18)23-20/h1-13H,14H2,(H,22,25).
What are the key properties of 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide?
2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide has a molecular weight of 344.37 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)-N-phenylacetamide is sourced from PubChem (CID 118712384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).