6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one

C15H10F2N2O — CID 162418135

IUPAC6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one
SMILESCn1c(=O)c(-c2ccccc2)nc2cc(F)c(F)cc21
InChIInChI=1S/C15H10F2N2O/c1-19-13-8-11(17)10(16)7-12(13)18-14(15(19)20)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyBZLFVFNFKISHHD-UHFFFAOYSA-N
MW272.25 g/mol
LogP2.88
Rot. Bonds1

About 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one

6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one (PubChem CID 162418135) has the molecular formula C15H10F2N2O and a molecular weight of 272.25 g/mol. Its IUPAC name is 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one.

Molecular Properties

Compound Name6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one
PubChem CID162418135
Molecular FormulaC15H10F2N2O
Molecular Weight272.25 g/mol
Exact Mass272.08
IUPAC Name6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one
SMILESCn1c(=O)c(-c2ccccc2)nc2cc(F)c(F)cc21
InChIInChI=1S/C15H10F2N2O/c1-19-13-8-11(17)10(16)7-12(13)18-14(15(19)20)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyBZLFVFNFKISHHD-UHFFFAOYSA-N
XLogP2.88
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.25
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-chloro-1-methyl-3-phenylquinoxalin-2-one
CID 163364599
6-bromo-1-methyl-3-phenylquinoxalin-2-one
CID 132610074
3-(4-bromophenyl)-1-methylquinoxalin-2-one
CID 132610080
5,6-difluoro-1-methylbenzimidazol-2-amine
CID 82359172
5-chloro-1-methyl-3-phenylpyrido[2,3-g]quinoxalin-2-one
CID 127035059
3-(5,6-difluoro-2-phenylbenzimidazol-1-yl)propanoic acid
CID 82146187
7-methyl-2-phenylimidazo[1,2-a]pyrazin-3-one
CID 71346482
3-(5,6-difluoro-2-phenylbenzimidazol-1-yl)propan-1-amine
CID 82146184
7,8-difluoro-1-phenylpyrido[1,2-a]benzimidazole
CID 162353197
4-(4-methyl-3-oxoquinoxalin-2-yl)-N-propan-2-ylbenzamide
CID 46395275
1-(methylsulfanylmethyl)-3-phenylquinoxalin-2-one
CID 56693755
8-methyl-2-(4-methylpiperazin-1-yl)-6-phenylpteridin-7-one
CID 3234627

Frequently Asked Questions

What is the IUPAC name of 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one?
The IUPAC name of 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one (CID 162418135) is 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one.
What is the SMILES notation for 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one?
The canonical SMILES for 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one is Cn1c(=O)c(-c2ccccc2)nc2cc(F)c(F)cc21.
What is the InChIKey of 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one?
The InChIKey is BZLFVFNFKISHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N2O/c1-19-13-8-11(17)10(16)7-12(13)18-14(15(19)20)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one?
6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one has a molecular weight of 272.25 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-1-methyl-3-phenylquinoxalin-2-one is sourced from PubChem (CID 162418135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).