4-acetyl-1,3-dihydroquinoxalin-2-one

C10H10N2O2 — CID 2770825

IUPAC4-acetyl-1,3-dihydroquinoxalin-2-one
SMILESCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C10H10N2O2/c1-7(13)12-6-10(14)11-8-4-2-3-5-9(8)12/h2-5H,6H2,1H3,(H,11,14)
InChIKeyZCJDYYGRHCAYGS-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.99
Rot. Bonds

About 4-acetyl-1,3-dihydroquinoxalin-2-one

4-acetyl-1,3-dihydroquinoxalin-2-one (PubChem CID 2770825) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 4-acetyl-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-acetyl-1,3-dihydroquinoxalin-2-one
PubChem CID2770825
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name4-acetyl-1,3-dihydroquinoxalin-2-one
SMILESCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C10H10N2O2/c1-7(13)12-6-10(14)11-8-4-2-3-5-9(8)12/h2-5H,6H2,1H3,(H,11,14)
InChIKeyZCJDYYGRHCAYGS-UHFFFAOYSA-N
XLogP0.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-acetyl-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-acetyl-1,3-dihydroquinoxalin-2-one (CID 2770825) is 4-acetyl-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-acetyl-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-acetyl-1,3-dihydroquinoxalin-2-one is CC(=O)N1CC(=O)Nc2ccccc21.
What is the InChIKey of 4-acetyl-1,3-dihydroquinoxalin-2-one?
The InChIKey is ZCJDYYGRHCAYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-7(13)12-6-10(14)11-8-4-2-3-5-9(8)12/h2-5H,6H2,1H3,(H,11,14).
What are the key properties of 4-acetyl-1,3-dihydroquinoxalin-2-one?
4-acetyl-1,3-dihydroquinoxalin-2-one has a molecular weight of 190.20 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetyl-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 2770825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).