N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide

C20H22N4O3 — CID 2946822

About N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide

N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide (PubChem CID 2946822) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide.

Molecular Properties

• Compound Name: N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
• PubChem CID: 2946822
• Molecular Formula: C20H22N4O3
• Molecular Weight: 366.42 g/mol
• Exact Mass: 366.17
• IUPAC Name: N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
• SMILES: CC(=O)Nc1ccc(NC(=O)CC2Nc3cc(C)c(C)cc3NC2=O)cc1
• InChI: InChI=1S/C20H22N4O3/c1-11-8-16-17(9-12(11)2)24-20(27)18(23-16)10-19(26)22-15-6-4-14(5-7-15)21-13(3)25/h4-9,18,23H,10H2,1-3H3,(H,21,25)(H,22,26)(H,24,27)
• InChIKey: GATWWYAGKGPQOU-UHFFFAOYSA-N
• XLogP: 3.02
• TPSA: 99.33 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	366.42
LogP ≤ 5	3.02
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide?

The IUPAC name of N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide (CID 2946822) is N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide.

What is the SMILES notation for N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide?

The canonical SMILES for N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide is CC(=O)Nc1ccc(NC(=O)CC2Nc3cc(C)c(C)cc3NC2=O)cc1.

What is the InChIKey of N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide?

The InChIKey is GATWWYAGKGPQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-11-8-16-17(9-12(11)2)24-20(27)18(23-16)10-19(26)22-15-6-4-14(5-7-15)21-13(3)25/h4-9,18,23H,10H2,1-3H3,(H,21,25)(H,22,26)(H,24,27).

What are the key properties of N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide?

N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide has a molecular weight of 366.42 g/mol, XLogP of 3.02, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-acetamidophenyl)-2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide is sourced from PubChem (CID 2946822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).