N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide

C19H19N3O4 — CID 2486964

IUPACN-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide
SMILESCOc1ccc(NC(=O)C2=CCC(=O)N(c3ccccc3)N2)cc1OC
InChIInChI=1S/C19H19N3O4/c1-25-16-10-8-13(12-17(16)26-2)20-19(24)15-9-11-18(23)22(21-15)14-6-4-3-5-7-14/h3-10,12,21H,11H2,1-2H3,(H,20,24)
InChIKeyVTBIWVMCHYPWQN-UHFFFAOYSA-N
MW353.38 g/mol
LogP2.47
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide

N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide (PubChem CID 2486964) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide
PubChem CID2486964
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide
SMILESCOc1ccc(NC(=O)C2=CCC(=O)N(c3ccccc3)N2)cc1OC
InChIInChI=1S/C19H19N3O4/c1-25-16-10-8-13(12-17(16)26-2)20-19(24)15-9-11-18(23)22(21-15)14-6-4-3-5-7-14/h3-10,12,21H,11H2,1-2H3,(H,20,24)
InChIKeyVTBIWVMCHYPWQN-UHFFFAOYSA-N
XLogP2.47
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-methylphenyl)-3-oxo-1,4-dihydropyridazine-6-carboxamide
CID 2024588
N-[(3,4-dimethoxyphenyl)carbamothioyl]-2,2-diphenylacetamide
CID 54781270
N-(3,4-dimethoxyphenyl)-1-phenyl-1,2,4-triazole-3-carboxamide
CID 15944274
N-(3,4-dimethoxyphenyl)-4-[(4-phenylpiperazin-1-yl)methyl]benzamide
CID 1363715
N-(3,4-dimethoxyphenyl)-4-oxo-3-phenylphthalazine-1-carboxamide
CID 26364775
N'-(3,4-dimethoxyphenyl)-N-phenyloxamide
CID 44999686
1-N-(3,4-dimethoxyphenyl)-4-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049317
N-(3,4-dimethoxyphenyl)-2-hydroxybenzamide
CID 18105958
1-(3,4-dimethoxyphenyl)-3-[(5-oxo-1-phenylpyrrolidin-3-yl)methyl]urea
CID 16919922
N-(3,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)benzamide
CID 17428588
N-(3,4-dimethoxyphenyl)-5-methoxy-4-oxo-1H-pyridine-2-carboxamide
CID 27376438
N-(3,4-dimethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 54781369

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide (CID 2486964) is N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide is COc1ccc(NC(=O)C2=CCC(=O)N(c3ccccc3)N2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide?
The InChIKey is VTBIWVMCHYPWQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-25-16-10-8-13(12-17(16)26-2)20-19(24)15-9-11-18(23)22(21-15)14-6-4-3-5-7-14/h3-10,12,21H,11H2,1-2H3,(H,20,24).
What are the key properties of N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide?
N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-3-oxo-2-phenyl-1,4-dihydropyridazine-6-carboxamide is sourced from PubChem (CID 2486964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).