6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide

C17H22N4O3 — CID 109114381

IUPAC6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)NCCCOC)nn1
InChIInChI=1S/C17H22N4O3/c1-3-24-15-8-5-4-7-13(15)19-16-10-9-14(20-21-16)17(22)18-11-6-12-23-2/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyZRDPCSYMIJDAQI-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.39
Rot. Bonds9

About 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide

6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide (PubChem CID 109114381) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
PubChem CID109114381
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)NCCCOC)nn1
InChIInChI=1S/C17H22N4O3/c1-3-24-15-8-5-4-7-13(15)19-16-10-9-14(20-21-16)17(22)18-11-6-12-23-2/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,22)(H,19,21)
InChIKeyZRDPCSYMIJDAQI-UHFFFAOYSA-N
XLogP2.39
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.39
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

6-(2-ethoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122308
6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109153373
6-(2-methoxyanilino)-N-pentylpyridazine-3-carboxamide
CID 109125507
6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124452
6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114000
6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127101
N-(2-ethoxyphenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127901
6-(5-chloro-2-methoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114375
6-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)pyridazine-3-carboxamide
CID 109129462
6-(5-chloro-2-methylanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114369
6-(2-ethylanilino)-N-[2-(4-methoxyphenoxy)ethyl]pyridazine-3-carboxamide
CID 109124679
N'-(2-ethoxyphenyl)-N-(3-methoxypropyl)oxamide
CID 2271593

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide (CID 109114381) is 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)NCCCOC)nn1.
What is the InChIKey of 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide?
The InChIKey is ZRDPCSYMIJDAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-3-24-15-8-5-4-7-13(15)19-16-10-9-14(20-21-16)17(22)18-11-6-12-23-2/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,22)(H,19,21).
What are the key properties of 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide?
6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 2.39, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109114381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).