8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione

C14H17N3O2 — CID 84637771

IUPAC8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
SMILESCCc1ccc2c(c1)N(C)C(=O)C1CNCC(=O)N21
InChIInChI=1S/C14H17N3O2/c1-3-9-4-5-10-11(6-9)16(2)14(19)12-7-15-8-13(18)17(10)12/h4-6,12,15H,3,7-8H2,1-2H3
InChIKeyWWMBTZDMLJYNAW-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.53
Rot. Bonds1

About 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione

8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione (PubChem CID 84637771) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione.

Molecular Properties

Compound Name8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
PubChem CID84637771
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
SMILESCCc1ccc2c(c1)N(C)C(=O)C1CNCC(=O)N21
InChIInChI=1S/C14H17N3O2/c1-3-9-4-5-10-11(6-9)16(2)14(19)12-7-15-8-13(18)17(10)12/h4-6,12,15H,3,7-8H2,1-2H3
InChIKeyWWMBTZDMLJYNAW-UHFFFAOYSA-N
XLogP0.53
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-fluoro-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
CID 84633414
9-ethyl-3,4,4a,6-tetrahydro-2H-pyrazino[1,2-a]quinoxaline-1,5-dione
CID 84631881
6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
CID 84631884
6,8-diethyl-2,3,4,4a-tetrahydro-1H-pyrazino[1,2-a]quinoxalin-5-one
CID 84637887
1,6-diethyl-4-methyl-3H-quinoxalin-2-one
CID 155066650
2-(aminomethyl)-6-ethyl-4-methyl-1,4-benzoxazin-3-one
CID 82231045
6-ethyl-1-methyl-3-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84627150
10-ethyl-6-methyl-2,3,4,4a-tetrahydro-1H-pyrazino[1,2-a]quinoxalin-5-one
CID 84632006
3,11-diethyl-5,8-dimethyl-11H-benzo[c][1]benzazepin-6-one
CID 59197960
8-methoxycarbonyl-6-methyl-5-oxo-2,3,4,4a-tetrahydro-1H-pyrazino[1,2-a]quinoxaline-1-carboxylic acid
CID 175493098
6-ethyl-1-oxo-3,4,4a,5-tetrahydro-2H-pyrazino[1,2-a]quinoxaline-9-carbonitrile
CID 84635970
(6R)-6-methyl-1-(2-methylphenyl)piperazin-2-one
CID 96582225

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The IUPAC name of 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione (CID 84637771) is 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione.
What is the SMILES notation for 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The canonical SMILES for 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione is CCc1ccc2c(c1)N(C)C(=O)C1CNCC(=O)N21.
What is the InChIKey of 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The InChIKey is WWMBTZDMLJYNAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-9-4-5-10-11(6-9)16(2)14(19)12-7-15-8-13(18)17(10)12/h4-6,12,15H,3,7-8H2,1-2H3.
What are the key properties of 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione has a molecular weight of 259.31 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione is sourced from PubChem (CID 84637771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).