2-(3-methoxy-6-oxopyridazin-1-yl)acetamide

C7H9N3O3 — CID 105062029

IUPAC2-(3-methoxy-6-oxopyridazin-1-yl)acetamide
SMILESCOc1ccc(=O)n(CC(N)=O)n1
InChIInChI=1S/C7H9N3O3/c1-13-6-2-3-7(12)10(9-6)4-5(8)11/h2-3H,4H2,1H3,(H2,8,11)
InChIKeyRDWSCUWAGXEPBE-UHFFFAOYSA-N
MW183.17 g/mol
LogP-1.26
Rot. Bonds3

About 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide

2-(3-methoxy-6-oxopyridazin-1-yl)acetamide (PubChem CID 105062029) has the molecular formula C7H9N3O3 and a molecular weight of 183.17 g/mol. Its IUPAC name is 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(3-methoxy-6-oxopyridazin-1-yl)acetamide
PubChem CID105062029
Molecular FormulaC7H9N3O3
Molecular Weight183.17 g/mol
Exact Mass183.06
IUPAC Name2-(3-methoxy-6-oxopyridazin-1-yl)acetamide
SMILESCOc1ccc(=O)n(CC(N)=O)n1
InChIInChI=1S/C7H9N3O3/c1-13-6-2-3-7(12)10(9-6)4-5(8)11/h2-3H,4H2,1H3,(H2,8,11)
InChIKeyRDWSCUWAGXEPBE-UHFFFAOYSA-N
XLogP-1.26
TPSA87.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-1.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide?
The IUPAC name of 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide (CID 105062029) is 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide is COc1ccc(=O)n(CC(N)=O)n1.
What is the InChIKey of 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide?
The InChIKey is RDWSCUWAGXEPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O3/c1-13-6-2-3-7(12)10(9-6)4-5(8)11/h2-3H,4H2,1H3,(H2,8,11).
What are the key properties of 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide?
2-(3-methoxy-6-oxopyridazin-1-yl)acetamide has a molecular weight of 183.17 g/mol, XLogP of -1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxy-6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 105062029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).