6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione

C13H15N3O2 — CID 84631884

IUPAC6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
SMILESCc1cccc2c1N1C(=O)CNCC1C(=O)N2C
InChIInChI=1S/C13H15N3O2/c1-8-4-3-5-9-12(8)16-10(13(18)15(9)2)6-14-7-11(16)17/h3-5,10,14H,6-7H2,1-2H3
InChIKeyQLQUITSSHYEIIS-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.28
Rot. Bonds

About 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione

6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione (PubChem CID 84631884) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione.

Molecular Properties

Compound Name6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
PubChem CID84631884
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
SMILESCc1cccc2c1N1C(=O)CNCC1C(=O)N2C
InChIInChI=1S/C13H15N3O2/c1-8-4-3-5-9-12(8)16-10(13(18)15(9)2)6-14-7-11(16)17/h3-5,10,14H,6-7H2,1-2H3
InChIKeyQLQUITSSHYEIIS-UHFFFAOYSA-N
XLogP0.28
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.28
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
(6R)-6-methyl-1-(2-methylphenyl)piperazin-2-one
CID 96582225
8-ethyl-6-methyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione
CID 84637771
10-ethyl-6-methyl-2,3,4,4a-tetrahydro-1H-pyrazino[1,2-a]quinoxalin-5-one
CID 84632006
1,5,6,10-tetramethylphenazine
CID 20660475
10-chloro-6-methyl-3,4,4a,5-tetrahydro-2H-pyrazino[1,2-a]quinoxalin-1-one
CID 84634503
5,6-dimethyl-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]quinolin-4-one
CID 68975938
7,8-dimethyl-3,4,4a,6-tetrahydro-2H-pyrazino[1,2-a]quinoxaline-1,5-dione
CID 84631890
9-(trifluoromethyl)-2,3,10,10a-tetrahydro-1H-pyrazino[1,2-a]indol-4-one
CID 115107411
6-fluoro-2,3,10,10a-tetrahydro-1H-pyrazino[1,2-a]indol-4-one
CID 84739860
10-bromo-6-ethyl-3,4,4a,5-tetrahydro-2H-pyrazino[1,2-a]quinoxalin-1-one
CID 84645296
3-(2,3-dimethylphenyl)imidazolidine-2,4-dione
CID 103935480

Frequently Asked Questions

What is the IUPAC name of 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The IUPAC name of 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione (CID 84631884) is 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione.
What is the SMILES notation for 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The canonical SMILES for 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione is Cc1cccc2c1N1C(=O)CNCC1C(=O)N2C.
What is the InChIKey of 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
The InChIKey is QLQUITSSHYEIIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-8-4-3-5-9-12(8)16-10(13(18)15(9)2)6-14-7-11(16)17/h3-5,10,14H,6-7H2,1-2H3.
What are the key properties of 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione?
6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione has a molecular weight of 245.28 g/mol, XLogP of 0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,10-dimethyl-2,3,4,4a-tetrahydropyrazino[1,2-a]quinoxaline-1,5-dione is sourced from PubChem (CID 84631884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).