4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one

C15H10F2N2O2 — CID 60620753

IUPAC4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)c2cccc(F)c2F)c2ccccc2N1
InChIInChI=1S/C15H10F2N2O2/c16-10-5-3-4-9(14(10)17)15(21)19-8-13(20)18-11-6-1-2-7-12(11)19/h1-7H,8H2,(H,18,20)
InChIKeyVTBRAEASTQMSRF-UHFFFAOYSA-N
MW288.25 g/mol
LogP2.56
Rot. Bonds1

About 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one

4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one (PubChem CID 60620753) has the molecular formula C15H10F2N2O2 and a molecular weight of 288.25 g/mol. Its IUPAC name is 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one
PubChem CID60620753
Molecular FormulaC15H10F2N2O2
Molecular Weight288.25 g/mol
Exact Mass288.07
IUPAC Name4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)c2cccc(F)c2F)c2ccccc2N1
InChIInChI=1S/C15H10F2N2O2/c16-10-5-3-4-9(14(10)17)15(21)19-8-13(20)18-11-6-1-2-7-12(11)19/h1-7H,8H2,(H,18,20)
InChIKeyVTBRAEASTQMSRF-UHFFFAOYSA-N
XLogP2.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.25
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-fluoro-4-methylbenzoyl)-1,3-dihydroquinoxalin-2-one
CID 79764947
5-(2-fluorobenzoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one
CID 3757029
4-(3-fluorobenzoyl)-1,3-dihydroquinoxalin-2-one
CID 3159804
4-(2-bromo-5-fluorobenzoyl)-1,3-dihydroquinoxalin-2-one
CID 28822405
4-(4-fluoro-2-methylbenzoyl)-1,3-dihydroquinoxalin-2-one
CID 115745127
4-[2-(methylaminomethyl)benzoyl]-1,3-dihydroquinoxalin-2-one
CID 69226926
4-(2-fluoro-4-methoxybenzoyl)-1,3-dihydroquinoxalin-2-one
CID 24568356
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-fluorobenzoate
CID 2431024
4-(2,5-dihydroxybenzoyl)-1,3-dihydroquinoxalin-2-one
CID 107722296
1-[4-(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)phenyl]-2-phenylethane-1,2-dione
CID 2445640
4-(2,2,2-trifluoroacetyl)-1,3-dihydroquinoxalin-2-one
CID 4749914
4-[4-(chloromethyl)benzoyl]-1,3-dihydroquinoxalin-2-one
CID 43333513

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one (CID 60620753) is 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one is O=C1CN(C(=O)c2cccc(F)c2F)c2ccccc2N1.
What is the InChIKey of 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one?
The InChIKey is VTBRAEASTQMSRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O2/c16-10-5-3-4-9(14(10)17)15(21)19-8-13(20)18-11-6-1-2-7-12(11)19/h1-7H,8H2,(H,18,20).
What are the key properties of 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one?
4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one has a molecular weight of 288.25 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-difluorobenzoyl)-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 60620753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).