N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide

C20H20N4O4 — CID 109129150

IUPACN-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(Nc3ccccc3OC)nn2)c1
InChIInChI=1S/C20H20N4O4/c1-26-13-8-10-18(28-3)16(12-13)22-20(25)15-9-11-19(24-23-15)21-14-6-4-5-7-17(14)27-2/h4-12H,1-3H3,(H,21,24)(H,22,25)
InChIKeyWXXIRBFEQUDRBO-UHFFFAOYSA-N
MW380.40 g/mol
LogP3.50
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide

N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide (PubChem CID 109129150) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
PubChem CID109129150
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC NameN-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(Nc3ccccc3OC)nn2)c1
InChIInChI=1S/C20H20N4O4/c1-26-13-8-10-18(28-3)16(12-13)22-20(25)15-9-11-19(24-23-15)21-14-6-4-5-7-17(14)27-2/h4-12H,1-3H3,(H,21,24)(H,22,25)
InChIKeyWXXIRBFEQUDRBO-UHFFFAOYSA-N
XLogP3.50
TPSA94.60 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.40
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-(2,5-dimethoxyanilino)-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 109129198
6-(2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridazine-3-carboxamide
CID 109129147
6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
CID 109129462
N-(2,4-dichlorophenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129176
6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129294
6-(2,4-dimethoxyanilino)-N-(2,3-dimethylphenyl)pyridazine-3-carboxamide
CID 109127873
N-(3-chlorophenyl)-6-(2,5-dimethoxyanilino)pyridazine-3-carboxamide
CID 109128702
N-(2,5-dimethoxyphenyl)-6-methoxypyridazine-3-carboxamide
CID 90509292
6-(2,5-dimethoxyanilino)-N-(3,4-dimethylphenyl)pyridazine-3-carboxamide
CID 109127680
6-(2-methoxyanilino)-N-(2,4,6-trimethylphenyl)pyridazine-3-carboxamide
CID 109128272
6-[(2-chlorophenyl)methylamino]-N-(2,5-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109119698
N-(2,4-dimethoxyphenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129247

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide (CID 109129150) is N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(Nc3ccccc3OC)nn2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The InChIKey is WXXIRBFEQUDRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-26-13-8-10-18(28-3)16(12-13)22-20(25)15-9-11-19(24-23-15)21-14-6-4-5-7-17(14)27-2/h4-12H,1-3H3,(H,21,24)(H,22,25).
What are the key properties of N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide has a molecular weight of 380.40 g/mol, XLogP of 3.50, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109129150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).