2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide

C6H7N3O3 — CID 45058881

IUPAC2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide
SMILESNC(=O)COc1ccc(=O)[nH]n1
InChIInChI=1S/C6H7N3O3/c7-4(10)3-12-6-2-1-5(11)8-9-6/h1-2H,3H2,(H2,7,10)(H,8,11)
InChIKeyGAFQRQDAWHJYKU-UHFFFAOYSA-N
MW169.14 g/mol
LogP-1.37
Rot. Bonds3

About 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide

2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide (PubChem CID 45058881) has the molecular formula C6H7N3O3 and a molecular weight of 169.14 g/mol. Its IUPAC name is 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide.

Molecular Properties

Compound Name2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide
PubChem CID45058881
Molecular FormulaC6H7N3O3
Molecular Weight169.14 g/mol
Exact Mass169.05
IUPAC Name2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide
SMILESNC(=O)COc1ccc(=O)[nH]n1
InChIInChI=1S/C6H7N3O3/c7-4(10)3-12-6-2-1-5(11)8-9-6/h1-2H,3H2,(H2,7,10)(H,8,11)
InChIKeyGAFQRQDAWHJYKU-UHFFFAOYSA-N
XLogP-1.37
TPSA98.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.14
LogP ≤ 5-1.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide?
The IUPAC name of 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide (CID 45058881) is 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide.
What is the SMILES notation for 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide?
The canonical SMILES for 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide is NC(=O)COc1ccc(=O)[nH]n1.
What is the InChIKey of 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide?
The InChIKey is GAFQRQDAWHJYKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3/c7-4(10)3-12-6-2-1-5(11)8-9-6/h1-2H,3H2,(H2,7,10)(H,8,11).
What are the key properties of 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide?
2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide has a molecular weight of 169.14 g/mol, XLogP of -1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-oxo-1H-pyridazin-3-yl)oxy]acetamide is sourced from PubChem (CID 45058881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).