6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide

C20H20N4O2 — CID 109127101

IUPAC6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)cc2)nn1
InChIInChI=1S/C20H20N4O2/c1-3-26-18-7-5-4-6-16(18)22-19-13-12-17(23-24-19)20(25)21-15-10-8-14(2)9-11-15/h4-13H,3H2,1-2H3,(H,21,25)(H,22,24)
InChIKeyBHQBPBIRGYMBQB-UHFFFAOYSA-N
MW348.41 g/mol
LogP4.18
Rot. Bonds6

About 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide

6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide (PubChem CID 109127101) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
PubChem CID109127101
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC Name6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)cc2)nn1
InChIInChI=1S/C20H20N4O2/c1-3-26-18-7-5-4-6-16(18)22-19-13-12-17(23-24-19)20(25)21-15-10-8-14(2)9-11-15/h4-13H,3H2,1-2H3,(H,21,25)(H,22,24)
InChIKeyBHQBPBIRGYMBQB-UHFFFAOYSA-N
XLogP4.18
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-difluorophenyl)-6-(2-ethoxyanilino)pyridazine-3-carboxamide
CID 109129455
ethyl 2-[[6-[(4-methylphenyl)carbamoyl]pyridazin-3-yl]amino]benzoate
CID 109127135
5-(2-ethoxyanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290053
4-(2-ethoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219228
N-(2-ethoxyphenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127901
N-(2-ethoxyphenyl)-6-(4-ethylanilino)pyridazine-3-carboxamide
CID 109127965
6-(2,5-dimethylanilino)-N-(4-ethoxyphenyl)pyridazine-3-carboxamide
CID 109127582
ethyl 2-[[6-[(4-fluorophenyl)carbamoyl]pyridazin-3-yl]amino]benzoate
CID 109128564
6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
CID 109129462
6-(4-methylanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127010
6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114381
6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124452

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide (CID 109127101) is 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)Nc2ccc(C)cc2)nn1.
What is the InChIKey of 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
The InChIKey is BHQBPBIRGYMBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-3-26-18-7-5-4-6-16(18)22-19-13-12-17(23-24-19)20(25)21-15-10-8-14(2)9-11-15/h4-13H,3H2,1-2H3,(H,21,25)(H,22,24).
What are the key properties of 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide?
6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 4.18, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109127101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).