2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide

C15H13N3O4 — CID 113195542

IUPAC2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cn1c(=O)c(=O)[nH]c2ccccc21)NCc1ccco1
InChIInChI=1S/C15H13N3O4/c19-13(16-8-10-4-3-7-22-10)9-18-12-6-2-1-5-11(12)17-14(20)15(18)21/h1-7H,8-9H2,(H,16,19)(H,17,20)
InChIKeyRAFAQOWFHVDIHZ-UHFFFAOYSA-N
MW299.29 g/mol
LogP0.60
Rot. Bonds4

About 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide

2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 113195542) has the molecular formula C15H13N3O4 and a molecular weight of 299.29 g/mol. Its IUPAC name is 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID113195542
Molecular FormulaC15H13N3O4
Molecular Weight299.29 g/mol
Exact Mass299.09
IUPAC Name2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cn1c(=O)c(=O)[nH]c2ccccc21)NCc1ccco1
InChIInChI=1S/C15H13N3O4/c19-13(16-8-10-4-3-7-22-10)9-18-12-6-2-1-5-11(12)17-14(20)15(18)21/h1-7H,8-9H2,(H,16,19)(H,17,20)
InChIKeyRAFAQOWFHVDIHZ-UHFFFAOYSA-N
XLogP0.60
TPSA97.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.29
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 113195549
2-[2,4-dioxo-3-(2-phenylethyl)quinazolin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 22429523
2-[3-[2-(furan-2-ylmethylamino)-2-oxoethyl]-2,4-dioxoquinazolin-1-yl]-N-phenylacetamide
CID 22429989
2-[3-[(4-fluorophenyl)methyl]-2,4-dioxoquinazolin-1-yl]-N-(furan-2-ylmethyl)acetamide
CID 6502316
2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(4-fluorophenyl)acetamide
CID 113195630
6-(2,4-dioxo-1H-quinazolin-3-yl)-N-(furan-2-ylmethyl)hexanamide
CID 4639143
N-(furan-2-ylmethyl)-2-pyrrol-1-ylacetamide
CID 110688542
1-(furan-2-ylmethyl)-2-methyl-3-[2-(2-oxo-3H-benzimidazol-1-yl)ethyl]guanidine
CID 111824831
2-(2,5-dioxopyrrolidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 17034773
2-(6-fluoro-2,3-dioxo-4H-quinoxalin-1-yl)-N-[(2-fluorophenyl)methyl]acetamide
CID 113195740
N-[[1-[2-(furan-2-ylmethylamino)-2-oxoethyl]benzimidazol-2-yl]methyl]-2-methylpropanamide
CID 17029059
N-(furan-2-ylmethylcarbamoyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 2124377

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide (CID 113195542) is 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide is O=C(Cn1c(=O)c(=O)[nH]c2ccccc21)NCc1ccco1.
What is the InChIKey of 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is RAFAQOWFHVDIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O4/c19-13(16-8-10-4-3-7-22-10)9-18-12-6-2-1-5-11(12)17-14(20)15(18)21/h1-7H,8-9H2,(H,16,19)(H,17,20).
What are the key properties of 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide?
2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 299.29 g/mol, XLogP of 0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dioxo-4H-quinoxalin-1-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 113195542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).