6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide

C22H24N4O3 — CID 109124679

IUPAC6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)NCCOc2ccc(OC)cc2)nn1
InChIInChI=1S/C22H24N4O3/c1-3-16-6-4-5-7-19(16)24-21-13-12-20(25-26-21)22(27)23-14-15-29-18-10-8-17(28-2)9-11-18/h4-13H,3,14-15H2,1-2H3,(H,23,27)(H,24,26)
InChIKeyYQUUAANZQCNROM-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.60
Rot. Bonds9

About 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide

6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide (PubChem CID 109124679) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
PubChem CID109124679
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC Name6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
SMILESCCc1ccccc1Nc1ccc(C(=O)NCCOc2ccc(OC)cc2)nn1
InChIInChI=1S/C22H24N4O3/c1-3-16-6-4-5-7-19(16)24-21-13-12-20(25-26-21)22(27)23-14-15-29-18-10-8-17(28-2)9-11-18/h4-13H,3,14-15H2,1-2H3,(H,23,27)(H,24,26)
InChIKeyYQUUAANZQCNROM-UHFFFAOYSA-N
XLogP3.60
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2-carboxamide
CID 109216750
6-(3,4-dimethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109124675
N-[6-(2-ethylanilino)pyridazin-3-yl]-4-methoxybenzamide
CID 113046649
N-[2-(4-methoxyphenyl)ethyl]-6-(2-methylanilino)pyridazine-3-carboxamide
CID 109122525
6-[2-(4-methoxyphenoxy)ethylamino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109121641
6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114000
N-[6-(2-ethylanilino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113046657
6-(methylamino)-N-(2-phenoxyethyl)pyridazine-3-carboxamide
CID 62179050
5-(2-fluoroanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyrazine-2-carboxamide
CID 109287152
6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114381
6-(cycloheptylamino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109124661
6-(2-ethoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122308

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide (CID 109124679) is 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide is CCc1ccccc1Nc1ccc(C(=O)NCCOc2ccc(OC)cc2)nn1.
What is the InChIKey of 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide?
The InChIKey is YQUUAANZQCNROM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-3-16-6-4-5-7-19(16)24-21-13-12-20(25-26-21)22(27)23-14-15-29-18-10-8-17(28-2)9-11-18/h4-13H,3,14-15H2,1-2H3,(H,23,27)(H,24,26).
What are the key properties of 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide?
6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 3.60, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 109124679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).