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

C21H22N4O4 — CID 109129462

IUPAC6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2ccc(OC)cc2OC)nn1
InChIInChI=1S/C21H22N4O4/c1-4-29-18-8-6-5-7-15(18)23-21(26)17-11-12-20(25-24-17)22-16-10-9-14(27-2)13-19(16)28-3/h5-13H,4H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyGNDYAVBYABKRKR-UHFFFAOYSA-N
MW394.43 g/mol
LogP3.89
Rot. Bonds8

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

6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide (PubChem CID 109129462) has the molecular formula C21H22N4O4 and a molecular weight of 394.43 g/mol. Its IUPAC name is 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
PubChem CID109129462
Molecular FormulaC21H22N4O4
Molecular Weight394.43 g/mol
Exact Mass394.16
IUPAC Name6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1ccc(Nc2ccc(OC)cc2OC)nn1
InChIInChI=1S/C21H22N4O4/c1-4-29-18-8-6-5-7-15(18)23-21(26)17-11-12-20(25-24-17)22-16-10-9-14(27-2)13-19(16)28-3/h5-13H,4H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyGNDYAVBYABKRKR-UHFFFAOYSA-N
XLogP3.89
TPSA94.60 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.43
LogP ≤ 53.89
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
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
N-(2,4-dimethoxyphenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129247
6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129294
N-(2-ethoxyphenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127901
6-(2,4-dimethoxyanilino)-N-(2,3-dimethylphenyl)pyridazine-3-carboxamide
CID 109127873
2-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyrimidine-4-carboxamide
CID 109317827
6-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109129699
5-(2,5-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109199964
6-(2,4-dimethoxyanilino)-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109127745
6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127101
6-(4-chloroanilino)-N-(2,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109128741

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide (CID 109129462) is 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide is CCOc1ccccc1NC(=O)c1ccc(Nc2ccc(OC)cc2OC)nn1.
What is the InChIKey of 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide?
The InChIKey is GNDYAVBYABKRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O4/c1-4-29-18-8-6-5-7-15(18)23-21(26)17-11-12-20(25-24-17)22-16-10-9-14(27-2)13-19(16)28-3/h5-13H,4H2,1-3H3,(H,22,25)(H,23,26).
What are the key properties of 6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide?
6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide has a molecular weight of 394.43 g/mol, XLogP of 3.89, 8 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-(2-ethoxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109129462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).