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

C19H14N4O2 — CID 57441057

IUPACN-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide
SMILESO=C(Nc1cccc(Oc2ccc3nccn3n2)c1)c1ccccc1
InChIInChI=1S/C19H14N4O2/c24-19(14-5-2-1-3-6-14)21-15-7-4-8-16(13-15)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24)
InChIKeyQXXOTAZGPKNRIV-UHFFFAOYSA-N
MW330.35 g/mol
LogP3.77
Rot. Bonds4

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

N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide (PubChem CID 57441057) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide.

Molecular Properties

Compound NameN-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide
PubChem CID57441057
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC NameN-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide
SMILESO=C(Nc1cccc(Oc2ccc3nccn3n2)c1)c1ccccc1
InChIInChI=1S/C19H14N4O2/c24-19(14-5-2-1-3-6-14)21-15-7-4-8-16(13-15)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24)
InChIKeyQXXOTAZGPKNRIV-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 N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide?
The IUPAC name of N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide (CID 57441057) is N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide.
What is the SMILES notation for N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide?
The canonical SMILES for N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide is O=C(Nc1cccc(Oc2ccc3nccn3n2)c1)c1ccccc1.
What is the InChIKey of N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide?
The InChIKey is QXXOTAZGPKNRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c24-19(14-5-2-1-3-6-14)21-15-7-4-8-16(13-15)25-18-10-9-17-20-11-12-23(17)22-18/h1-13H,(H,21,24).
What are the key properties of N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide?
N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide 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 N-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)benzamide is sourced from PubChem (CID 57441057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).