N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide

C17H19N3O4 — CID 110223079

IUPACN-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2nc3c(cc2=O)COC3C)cc1
InChIInChI=1S/C17H19N3O4/c1-3-23-14-6-4-13(5-7-14)18-15(21)9-20-16(22)8-12-10-24-11(2)17(12)19-20/h4-8,11H,3,9-10H2,1-2H3,(H,18,21)
InChIKeyYFOFAWYKTVGRCL-UHFFFAOYSA-N
MW329.36 g/mol
LogP1.87
Rot. Bonds5

About N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide

N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide (PubChem CID 110223079) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide
PubChem CID110223079
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC NameN-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2nc3c(cc2=O)COC3C)cc1
InChIInChI=1S/C17H19N3O4/c1-3-23-14-6-4-13(5-7-14)18-15(21)9-20-16(22)8-12-10-24-11(2)17(12)19-20/h4-8,11H,3,9-10H2,1-2H3,(H,18,21)
InChIKeyYFOFAWYKTVGRCL-UHFFFAOYSA-N
XLogP1.87
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chlorophenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide
CID 110223080
2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]-N-(4-fluorophenyl)acetamide
CID 7662136
2-[4-[2-(4-ethoxyanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-ethoxyphenyl)acetamide
CID 20970562
N-(4-ethoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 8544001
2-(2-cyclohexyl-5-methyl-7-oxo-[1,2,4]triazolo[1,5-a]pyrimidin-4-yl)-N-(4-ethoxyphenyl)acetamide
CID 50750710
ethyl 4-[[2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]acetyl]amino]benzoate
CID 7662139
2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 7662101
2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-[4-(4-ethoxyphenoxy)phenyl]acetamide
CID 8899247
N-(4-bromophenyl)-2-[8-(4-ethoxyphenyl)-3,4-dioxo-6,7-dihydroimidazo[2,1-c][1,2,4]triazin-2-yl]acetamide
CID 16898406
N-(4-ethoxyphenyl)-2-[5-(4-fluorophenyl)-2-oxo-1,3,4-oxadiazol-3-yl]acetamide
CID 9040319
2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]-N-(4-methylsulfanylphenyl)acetamide
CID 121063779
N-(4-ethoxyphenyl)-2-[(2R)-2-methylpiperidin-1-yl]acetamide
CID 8583349

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide (CID 110223079) is N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide is CCOc1ccc(NC(=O)Cn2nc3c(cc2=O)COC3C)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide?
The InChIKey is YFOFAWYKTVGRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-3-23-14-6-4-13(5-7-14)18-15(21)9-20-16(22)8-12-10-24-11(2)17(12)19-20/h4-8,11H,3,9-10H2,1-2H3,(H,18,21).
What are the key properties of N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide?
N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide has a molecular weight of 329.36 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-(7-methyl-3-oxo-5,7-dihydrofuro[3,4-c]pyridazin-2-yl)acetamide is sourced from PubChem (CID 110223079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).