2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide

C13H22N4O2 — CID 113039400

IUPAC2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(NCCOC)nn1
InChIInChI=1S/C13H22N4O2/c1-4-10(5-2)13(18)15-12-7-6-11(16-17-12)14-8-9-19-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,16)(H,15,17,18)
InChIKeyLQWLGEOUYMWVOR-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.91
Rot. Bonds8

About 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide

2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide (PubChem CID 113039400) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide
PubChem CID113039400
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(NCCOC)nn1
InChIInChI=1S/C13H22N4O2/c1-4-10(5-2)13(18)15-12-7-6-11(16-17-12)14-8-9-19-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,16)(H,15,17,18)
InChIKeyLQWLGEOUYMWVOR-UHFFFAOYSA-N
XLogP1.91
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[6-(2-methoxyethylamino)pyridazin-3-yl]propanamide
CID 113039391
2-ethyl-N-[6-(pentylamino)pyridazin-3-yl]butanamide
CID 113044637
2-ethyl-N-[6-(3-phenylpropylamino)pyridazin-3-yl]butanamide
CID 113044086
4-tert-butyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]benzamide
CID 113039421
N-[6-[(3,4-dimethoxyphenyl)methylamino]pyridazin-3-yl]-2-ethylbutanamide
CID 113043351
2-(2-fluorophenyl)-N-[6-(2-methoxyethylamino)pyridazin-3-yl]acetamide
CID 113039450
2-ethyl-N-[6-(4-methoxyanilino)pyridazin-3-yl]butanamide
CID 113048284
1-cyclopropyl-3-[6-(2-methoxyethylamino)pyridazin-3-yl]urea
CID 113039466
methyl 4-[[6-(2-ethylbutanoylamino)pyridazin-3-yl]amino]benzoate
CID 113049466
2-ethyl-N-[6-[2-(1H-indol-3-yl)ethylamino]pyridazin-3-yl]butanamide
CID 113043185
2-ethyl-N-[6-(3,4,5-trimethoxyanilino)pyridazin-3-yl]butanamide
CID 113050576
2-(3-fluorophenyl)-N-[6-(2-methoxyethylamino)pyridazin-3-yl]acetamide
CID 113039451

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide?
The IUPAC name of 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide (CID 113039400) is 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide.
What is the SMILES notation for 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide?
The canonical SMILES for 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide is CCC(CC)C(=O)Nc1ccc(NCCOC)nn1.
What is the InChIKey of 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide?
The InChIKey is LQWLGEOUYMWVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-10(5-2)13(18)15-12-7-6-11(16-17-12)14-8-9-19-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,14,16)(H,15,17,18).
What are the key properties of 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide?
2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide has a molecular weight of 266.34 g/mol, XLogP of 1.91, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[6-(2-methoxyethylamino)pyridazin-3-yl]butanamide is sourced from PubChem (CID 113039400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).