N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide

C19H19N3O3 — CID 46356937

IUPACN-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide
SMILESCN(Cc1ccccc1)C(=O)Cn1c(=O)c(=O)n(C)c2ccccc21
InChIInChI=1S/C19H19N3O3/c1-20(12-14-8-4-3-5-9-14)17(23)13-22-16-11-7-6-10-15(16)21(2)18(24)19(22)25/h3-11H,12-13H2,1-2H3
InChIKeyRVQCPFXFKGYUOF-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.36
Rot. Bonds4

About N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide

N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide (PubChem CID 46356937) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide
PubChem CID46356937
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide
SMILESCN(Cc1ccccc1)C(=O)Cn1c(=O)c(=O)n(C)c2ccccc21
InChIInChI=1S/C19H19N3O3/c1-20(12-14-8-4-3-5-9-14)17(23)13-22-16-11-7-6-10-15(16)21(2)18(24)19(22)25/h3-11H,12-13H2,1-2H3
InChIKeyRVQCPFXFKGYUOF-UHFFFAOYSA-N
XLogP1.36
TPSA64.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-[(2R)-1-[benzyl(methyl)amino]butan-2-yl]-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide
CID 92752265
N-benzyl-2-(3-methyl-2-oxobenzimidazol-1-yl)-N-phenylacetamide
CID 24603426
N-benzyl-N-methyl-3-(4-methyl-3-oxoquinoxalin-2-yl)propanamide
CID 110205815
N-benzyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-methylacetamide
CID 60645191
N-benzyl-N-methyl-2-(2-propan-2-ylbenzimidazol-1-yl)acetamide
CID 16996582
N,N-dimethyl-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
CID 664799
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-benzyl-N-methyl-2-[2-[(4-phenylphenyl)methyl]benzimidazol-1-yl]acetamide
CID 16987485
N-benzyl-N-methyl-2-(2-oxo-3-phenylimidazo[4,5-b]pyridin-1-yl)acetamide
CID 53159300
N-benzyl-N-ethyl-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 18134876
4-[[[2-(3-ethyl-2-oxobenzimidazol-1-yl)acetyl]-methylamino]methyl]-N-methylbenzamide
CID 38744872
1-methyl-4-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]quinoxaline-2,3-dione
CID 46786232

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide (CID 46356937) is N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide is CN(Cc1ccccc1)C(=O)Cn1c(=O)c(=O)n(C)c2ccccc21.
What is the InChIKey of N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide?
The InChIKey is RVQCPFXFKGYUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-20(12-14-8-4-3-5-9-14)17(23)13-22-16-11-7-6-10-15(16)21(2)18(24)19(22)25/h3-11H,12-13H2,1-2H3.
What are the key properties of N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide?
N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide has a molecular weight of 337.38 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-(4-methyl-2,3-dioxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 46356937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).