2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide

C16H20N4O2 — CID 113037821

IUPAC2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
SMILESCCCNc1ccc(NC(=O)Cc2ccc(OC)cc2)nn1
InChIInChI=1S/C16H20N4O2/c1-3-10-17-14-8-9-15(20-19-14)18-16(21)11-12-4-6-13(22-2)7-5-12/h4-9H,3,10-11H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyPQHUXNCWZFXADB-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.49
Rot. Bonds7

About 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide

2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide (PubChem CID 113037821) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
PubChem CID113037821
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
SMILESCCCNc1ccc(NC(=O)Cc2ccc(OC)cc2)nn1
InChIInChI=1S/C16H20N4O2/c1-3-10-17-14-8-9-15(20-19-14)18-16(21)11-12-4-6-13(22-2)7-5-12/h4-9H,3,10-11H2,1-2H3,(H,17,19)(H,18,20,21)
InChIKeyPQHUXNCWZFXADB-UHFFFAOYSA-N
XLogP2.49
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)-N-[6-(3-methoxypropylamino)pyridazin-3-yl]acetamide
CID 113039555
2-(4-fluorophenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
CID 113037819
2-phenyl-N-[6-(propylamino)pyridazin-3-yl]acetamide
CID 113037818
2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide
CID 113040895
2-(4-methoxyphenyl)-N-[6-(2-morpholin-4-ylethylamino)pyridazin-3-yl]acetamide
CID 113040037
N-[6-(2-ethylanilino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113046657
N-[6-(furan-2-ylmethylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113040667
N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113038853
2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide
CID 113041787
N-[6-(4-acetylanilino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113049153
N-[6-[2-(4-methoxyphenyl)ethylamino]pyridazin-3-yl]cyclopropanecarboxamide
CID 113042762
N-[6-[2-(4-methoxyphenyl)ethylamino]pyridazin-3-yl]-2-phenoxyacetamide
CID 113042788

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide (CID 113037821) is 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide is CCCNc1ccc(NC(=O)Cc2ccc(OC)cc2)nn1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide?
The InChIKey is PQHUXNCWZFXADB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-3-10-17-14-8-9-15(20-19-14)18-16(21)11-12-4-6-13(22-2)7-5-12/h4-9H,3,10-11H2,1-2H3,(H,17,19)(H,18,20,21).
What are the key properties of 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide?
2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.49, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide is sourced from PubChem (CID 113037821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).