2-methyl-6-(4-methylphenyl)pyridazin-3-one

C12H12N2O — CID 7027991

IUPAC2-methyl-6-(4-methylphenyl)pyridazin-3-one
SMILESCc1ccc(-c2ccc(=O)n(C)n2)cc1
InChIInChI=1S/C12H12N2O/c1-9-3-5-10(6-4-9)11-7-8-12(15)14(2)13-11/h3-8H,1-2H3
InChIKeyUTTJKGXRNRHATD-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.76
Rot. Bonds1

About 2-methyl-6-(4-methylphenyl)pyridazin-3-one

2-methyl-6-(4-methylphenyl)pyridazin-3-one (PubChem CID 7027991) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 2-methyl-6-(4-methylphenyl)pyridazin-3-one.

Molecular Properties

Compound Name2-methyl-6-(4-methylphenyl)pyridazin-3-one
PubChem CID7027991
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name2-methyl-6-(4-methylphenyl)pyridazin-3-one
SMILESCc1ccc(-c2ccc(=O)n(C)n2)cc1
InChIInChI=1S/C12H12N2O/c1-9-3-5-10(6-4-9)11-7-8-12(15)14(2)13-11/h3-8H,1-2H3
InChIKeyUTTJKGXRNRHATD-UHFFFAOYSA-N
XLogP1.76
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-methylphenyl)pyridazin-3-one?
The IUPAC name of 2-methyl-6-(4-methylphenyl)pyridazin-3-one (CID 7027991) is 2-methyl-6-(4-methylphenyl)pyridazin-3-one.
What is the SMILES notation for 2-methyl-6-(4-methylphenyl)pyridazin-3-one?
The canonical SMILES for 2-methyl-6-(4-methylphenyl)pyridazin-3-one is Cc1ccc(-c2ccc(=O)n(C)n2)cc1.
What is the InChIKey of 2-methyl-6-(4-methylphenyl)pyridazin-3-one?
The InChIKey is UTTJKGXRNRHATD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-3-5-10(6-4-9)11-7-8-12(15)14(2)13-11/h3-8H,1-2H3.
What are the key properties of 2-methyl-6-(4-methylphenyl)pyridazin-3-one?
2-methyl-6-(4-methylphenyl)pyridazin-3-one has a molecular weight of 200.24 g/mol, XLogP of 1.76, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-methylphenyl)pyridazin-3-one is sourced from PubChem (CID 7027991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).