6-acetyl-2-methylpyridazin-3-one

C7H8N2O2 — CID 82442150

IUPAC6-acetyl-2-methylpyridazin-3-one
SMILESCC(=O)c1ccc(=O)n(C)n1
InChIInChI=1S/C7H8N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H,1-2H3
InChIKeyQCKQVEREISNVCB-UHFFFAOYSA-N
MW152.15 g/mol
LogP-0.02
Rot. Bonds1

About 6-acetyl-2-methylpyridazin-3-one

6-acetyl-2-methylpyridazin-3-one (PubChem CID 82442150) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 6-acetyl-2-methylpyridazin-3-one.

Molecular Properties

Compound Name6-acetyl-2-methylpyridazin-3-one
PubChem CID82442150
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name6-acetyl-2-methylpyridazin-3-one
SMILESCC(=O)c1ccc(=O)n(C)n1
InChIInChI=1S/C7H8N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H,1-2H3
InChIKeyQCKQVEREISNVCB-UHFFFAOYSA-N
XLogP-0.02
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-acetyl-2-methylpyridazin-3-one?
The IUPAC name of 6-acetyl-2-methylpyridazin-3-one (CID 82442150) is 6-acetyl-2-methylpyridazin-3-one.
What is the SMILES notation for 6-acetyl-2-methylpyridazin-3-one?
The canonical SMILES for 6-acetyl-2-methylpyridazin-3-one is CC(=O)c1ccc(=O)n(C)n1.
What is the InChIKey of 6-acetyl-2-methylpyridazin-3-one?
The InChIKey is QCKQVEREISNVCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H,1-2H3.
What are the key properties of 6-acetyl-2-methylpyridazin-3-one?
6-acetyl-2-methylpyridazin-3-one has a molecular weight of 152.15 g/mol, XLogP of -0.02, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-2-methylpyridazin-3-one is sourced from PubChem (CID 82442150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).