N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide

C17H14FN3O2 — CID 46365046

IUPACN-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C17H14FN3O2/c1-10-7-8-11(18)9-13(10)20-16(22)15-17(23)21(2)14-6-4-3-5-12(14)19-15/h3-9H,1-2H3,(H,20,22)
InChIKeyWODISFAZMPQMTI-UHFFFAOYSA-N
MW311.32 g/mol
LogP2.63
Rot. Bonds2

About N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide

N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide (PubChem CID 46365046) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
PubChem CID46365046
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC NameN-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1nc2ccccc2n(C)c1=O
InChIInChI=1S/C17H14FN3O2/c1-10-7-8-11(18)9-13(10)20-16(22)15-17(23)21(2)14-6-4-3-5-12(14)19-15/h3-9H,1-2H3,(H,20,22)
InChIKeyWODISFAZMPQMTI-UHFFFAOYSA-N
XLogP2.63
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide 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

N-(2,6-dimethylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46365020
N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46976116
N-(2,5-dimethoxyphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46364976
4-methyl-3-oxo-N-pyridin-2-ylquinoxaline-2-carboxamide
CID 53009406
N-[2-(2-ethoxyphenyl)phenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46976106
N-[2-[2-(dimethylamino)ethoxy]-5-methylphenyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46976122
4-ethyl-N-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxamide
CID 50808114
N-(5-fluoro-2-methylphenyl)-4-oxo-3-phenylphthalazine-1-carboxamide
CID 4810818
4-methyl-3-oxo-N-[(1R)-1-phenylethyl]quinoxaline-2-carboxamide
CID 92877606
N-[[4-(3-fluorophenyl)oxan-4-yl]methyl]-4-methyl-3-oxoquinoxaline-2-carboxamide
CID 46976130
3-ethoxy-N-(5-fluoro-2-methylphenyl)-6,7-dimethylquinoxaline-2-carboxamide
CID 50780142
N-(5-fluoro-2-methylphenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide
CID 4799414

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide (CID 46365046) is N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide is Cc1ccc(F)cc1NC(=O)c1nc2ccccc2n(C)c1=O.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
The InChIKey is WODISFAZMPQMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c1-10-7-8-11(18)9-13(10)20-16(22)15-17(23)21(2)14-6-4-3-5-12(14)19-15/h3-9H,1-2H3,(H,20,22).
What are the key properties of N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide?
N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide has a molecular weight of 311.32 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-4-methyl-3-oxoquinoxaline-2-carboxamide is sourced from PubChem (CID 46365046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).