2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one

C14H15N3O — CID 103964979

IUPAC2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one
SMILESCCC1(C)Nc2c(cnc3ccccc23)NC1=O
InChIInChI=1S/C14H15N3O/c1-3-14(2)13(18)16-11-8-15-10-7-5-4-6-9(10)12(11)17-14/h4-8,17H,3H2,1-2H3,(H,16,18)
InChIKeyLHVIFKITECGPDN-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.77
Rot. Bonds1

About 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one

2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one (PubChem CID 103964979) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one.

Molecular Properties

Compound Name2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one
PubChem CID103964979
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one
SMILESCCC1(C)Nc2c(cnc3ccccc23)NC1=O
InChIInChI=1S/C14H15N3O/c1-3-14(2)13(18)16-11-8-15-10-7-5-4-6-9(10)12(11)17-14/h4-8,17H,3H2,1-2H3,(H,16,18)
InChIKeyLHVIFKITECGPDN-UHFFFAOYSA-N
XLogP2.77
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one?
The IUPAC name of 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one (CID 103964979) is 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one.
What is the SMILES notation for 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one?
The canonical SMILES for 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one is CCC1(C)Nc2c(cnc3ccccc23)NC1=O.
What is the InChIKey of 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one?
The InChIKey is LHVIFKITECGPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-3-14(2)13(18)16-11-8-15-10-7-5-4-6-9(10)12(11)17-14/h4-8,17H,3H2,1-2H3,(H,16,18).
What are the key properties of 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one?
2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one has a molecular weight of 241.29 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-1,4-dihydropyrazino[2,3-c]quinolin-3-one is sourced from PubChem (CID 103964979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).