6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide

C20H20N4O4 — CID 109129294

IUPAC6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3ccc(OC)cc3OC)nn2)c1
InChIInChI=1S/C20H20N4O4/c1-26-14-6-4-5-13(11-14)21-20(25)17-9-10-19(24-23-17)22-16-8-7-15(27-2)12-18(16)28-3/h4-12H,1-3H3,(H,21,25)(H,22,24)
InChIKeyMRVDQPWKZYYLOG-UHFFFAOYSA-N
MW380.40 g/mol
LogP3.50
Rot. Bonds7

About 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide

6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide (PubChem CID 109129294) has the molecular formula C20H20N4O4 and a molecular weight of 380.40 g/mol. Its IUPAC name is 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
PubChem CID109129294
Molecular FormulaC20H20N4O4
Molecular Weight380.40 g/mol
Exact Mass380.15
IUPAC Name6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3ccc(OC)cc3OC)nn2)c1
InChIInChI=1S/C20H20N4O4/c1-26-14-6-4-5-13(11-14)21-20(25)17-9-10-19(24-23-17)22-16-8-7-15(27-2)12-18(16)28-3/h4-12H,1-3H3,(H,21,25)(H,22,24)
InChIKeyMRVDQPWKZYYLOG-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

N-(2,4-dimethoxyphenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129247
6-(2,4-dimethoxyanilino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109127745
5-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199779
N-(3-chloro-4-methylphenyl)-6-(2,4-dimethoxyanilino)pyridazine-3-carboxamide
CID 109128978
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-(2,4-dimethoxyphenyl)-6-(3-fluoroanilino)pyridazine-3-carboxamide
CID 109129697
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042566
6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
CID 109129462
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109126899
6-(2,4-dimethoxyanilino)-N-propan-2-ylpyridazine-3-carboxamide
CID 109109731

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide (CID 109129294) is 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide is COc1cccc(NC(=O)c2ccc(Nc3ccc(OC)cc3OC)nn2)c1.
What is the InChIKey of 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide?
The InChIKey is MRVDQPWKZYYLOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O4/c1-26-14-6-4-5-13(11-14)21-20(25)17-9-10-19(24-23-17)22-16-8-7-15(27-2)12-18(16)28-3/h4-12H,1-3H3,(H,21,25)(H,22,24).
What are the key properties of 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide?
6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)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 6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109129294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).