6-acetyl-2-methyl-4,5-dihydropyridazin-3-one

C7H10N2O2 — CID 59856275

IUPAC6-acetyl-2-methyl-4,5-dihydropyridazin-3-one
SMILESCC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C7H10N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H2,1-2H3
InChIKeyVOYFCIVDUZFLMN-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.18
Rot. Bonds1

About 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one

6-acetyl-2-methyl-4,5-dihydropyridazin-3-one (PubChem CID 59856275) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one.

Molecular Properties

Compound Name6-acetyl-2-methyl-4,5-dihydropyridazin-3-one
PubChem CID59856275
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name6-acetyl-2-methyl-4,5-dihydropyridazin-3-one
SMILESCC(=O)C1=NN(C)C(=O)CC1
InChIInChI=1S/C7H10N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H2,1-2H3
InChIKeyVOYFCIVDUZFLMN-UHFFFAOYSA-N
XLogP0.18
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one?
The IUPAC name of 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one (CID 59856275) is 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one.
What is the SMILES notation for 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one?
The canonical SMILES for 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one is CC(=O)C1=NN(C)C(=O)CC1.
What is the InChIKey of 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one?
The InChIKey is VOYFCIVDUZFLMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5(10)6-3-4-7(11)9(2)8-6/h3-4H2,1-2H3.
What are the key properties of 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one?
6-acetyl-2-methyl-4,5-dihydropyridazin-3-one has a molecular weight of 154.17 g/mol, XLogP of 0.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetyl-2-methyl-4,5-dihydropyridazin-3-one is sourced from PubChem (CID 59856275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).