N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide

C20H19N3O3 — CID 7992599

IUPACN-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide
SMILESCCn1c(=O)c(C)nc2cc(C(=O)Nc3cccc(C(C)=O)c3)ccc21
InChIInChI=1S/C20H19N3O3/c1-4-23-18-9-8-15(11-17(18)21-12(2)20(23)26)19(25)22-16-7-5-6-14(10-16)13(3)24/h5-11H,4H2,1-3H3,(H,22,25)
InChIKeyRUTRJLZDOUPUEP-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.18
Rot. Bonds4

About N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide

N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide (PubChem CID 7992599) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide
PubChem CID7992599
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide
SMILESCCn1c(=O)c(C)nc2cc(C(=O)Nc3cccc(C(C)=O)c3)ccc21
InChIInChI=1S/C20H19N3O3/c1-4-23-18-9-8-15(11-17(18)21-12(2)20(23)26)19(25)22-16-7-5-6-14(10-16)13(3)24/h5-11H,4H2,1-3H3,(H,22,25)
InChIKeyRUTRJLZDOUPUEP-UHFFFAOYSA-N
XLogP3.18
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxylic acid
CID 4962182
1-ethyl-3-methyl-2-oxo-N-(1,3,5-trimethylpyrazol-4-yl)quinoxaline-6-carboxamide
CID 24655019
1-ethyl-N-(4-methoxy-3-methylsulfanylphenyl)-3-methyl-2-oxoquinoxaline-6-carboxamide
CID 166236492
N-(3-acetylphenyl)-2-methyl-1-phenylbenzimidazole-5-carboxamide
CID 40723784
1-ethyl-3-methyl-N-(4-methyl-2-pyridinyl)-2-oxoquinoxaline-6-carboxamide
CID 35029668
1-(3-acetylphenyl)-3-(1-ethyl-2-methylbenzimidazol-5-yl)urea
CID 9267921
N-[4-[[(1-ethyl-2-methylbenzimidazole-5-carbonyl)amino]carbamoyl]phenyl]benzamide
CID 46633272
N-benzhydryl-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide
CID 7580923
1-ethyl-3-methyl-2-oxo-N-pentan-2-ylquinoxaline-6-carboxamide
CID 46684618
1-ethyl-3-methyl-2-oxo-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]quinoxaline-6-carboxamide
CID 36542675
1-ethyl-3-methyl-N-[(4-methylphenyl)methyl]-2-oxoquinoxaline-6-carboxamide
CID 9455424
1-ethyl-3-methyl-N-(5-methylhexan-2-yl)-2-oxoquinoxaline-6-carboxamide
CID 24659166

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide (CID 7992599) is N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide is CCn1c(=O)c(C)nc2cc(C(=O)Nc3cccc(C(C)=O)c3)ccc21.
What is the InChIKey of N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide?
The InChIKey is RUTRJLZDOUPUEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-4-23-18-9-8-15(11-17(18)21-12(2)20(23)26)19(25)22-16-7-5-6-14(10-16)13(3)24/h5-11H,4H2,1-3H3,(H,22,25).
What are the key properties of N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide?
N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-1-ethyl-3-methyl-2-oxoquinoxaline-6-carboxamide is sourced from PubChem (CID 7992599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).