N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide

C18H17N3O4 — CID 6500966

IUPACN-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCCOc1ccccc1NC(=O)Cn1nc(-c2ccco2)ccc1=O
InChIInChI=1S/C18H17N3O4/c1-2-24-15-7-4-3-6-13(15)19-17(22)12-21-18(23)10-9-14(20-21)16-8-5-11-25-16/h3-11H,2,12H2,1H3,(H,19,22)
InChIKeyVHZLGANANUEAAU-UHFFFAOYSA-N
MW339.35 g/mol
LogP2.54
Rot. Bonds6

About N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide

N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide (PubChem CID 6500966) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
PubChem CID6500966
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC NameN-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
SMILESCCOc1ccccc1NC(=O)Cn1nc(-c2ccco2)ccc1=O
InChIInChI=1S/C18H17N3O4/c1-2-24-15-7-4-3-6-13(15)19-17(22)12-21-18(23)10-9-14(20-21)16-8-5-11-25-16/h3-11H,2,12H2,1H3,(H,19,22)
InChIKeyVHZLGANANUEAAU-UHFFFAOYSA-N
XLogP2.54
TPSA86.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide (CID 6500966) is N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide is CCOc1ccccc1NC(=O)Cn1nc(-c2ccco2)ccc1=O.
What is the InChIKey of N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
The InChIKey is VHZLGANANUEAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c1-2-24-15-7-4-3-6-13(15)19-17(22)12-21-18(23)10-9-14(20-21)16-8-5-11-25-16/h3-11H,2,12H2,1H3,(H,19,22).
What are the key properties of N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide?
N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide has a molecular weight of 339.35 g/mol, XLogP of 2.54, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide is sourced from PubChem (CID 6500966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).