2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one

C15H18N4O — CID 4620890

IUPAC2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
SMILESCC/N=C1\Cn2c(nc3ccccc3c2=O)CN1CC
InChIInChI=1S/C15H18N4O/c1-3-16-13-10-19-14(9-18(13)4-2)17-12-8-6-5-7-11(12)15(19)20/h5-8H,3-4,9-10H2,1-2H3/b16-13+
InChIKeyNBVGOYZAMXYUCS-DTQAZKPQSA-N
MW270.34 g/mol
LogP1.65
Rot. Bonds2

About 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one

2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one (PubChem CID 4620890) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one.

Molecular Properties

Compound Name2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
PubChem CID4620890
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
SMILESCC/N=C1\Cn2c(nc3ccccc3c2=O)CN1CC
InChIInChI=1S/C15H18N4O/c1-3-16-13-10-19-14(9-18(13)4-2)17-12-8-6-5-7-11(12)15(19)20/h5-8H,3-4,9-10H2,1-2H3/b16-13+
InChIKeyNBVGOYZAMXYUCS-DTQAZKPQSA-N
XLogP1.65
TPSA50.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
CID 2160998
(4S)-2-benzyl-4-propan-2-yl-1,4-dihydropyrazino[2,1-b]quinazoline-3,6-dione
CID 10991635
1-[(2-methylphenyl)methyl]-2,3-dihydroimidazo[2,1-b]quinazolin-5-one
CID 22333369
3-ethyl-2-phenylquinazolin-4-one
CID 12626608
2-ethyl-3-phenylquinazolin-4-one
CID 719985
3-methyl-3-(2,2,2-trifluoroethyl)-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one
CID 132603346
1-(2-methylpropyl)-2,4-dihydro-1H-pyrazino[2,1-b]quinazoline-3,6-dione
CID 156641715
3-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-1,2,4,5-tetrahydro-[1,4]diazepino[7,1-b]quinazolin-11-one
CID 110244676
3-ethyl-4-oxoquinazoline-2-carbonitrile
CID 10655605
3-[4-(4-oxo-2-propylquinazolin-3-yl)phenyl]-2-propylquinazolin-4-one
CID 12631795
ethane;2-ethyl-3-methylquinazolin-4-one
CID 143999559
(1S)-3-ethoxy-1-propan-2-yl-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
CID 16681423

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The IUPAC name of 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one (CID 4620890) is 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one.
What is the SMILES notation for 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The canonical SMILES for 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one is CC/N=C1\Cn2c(nc3ccccc3c2=O)CN1CC.
What is the InChIKey of 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The InChIKey is NBVGOYZAMXYUCS-DTQAZKPQSA-N. The full InChI is InChI=1S/C15H18N4O/c1-3-16-13-10-19-14(9-18(13)4-2)17-12-8-6-5-7-11(12)15(19)20/h5-8H,3-4,9-10H2,1-2H3/b16-13+.
What are the key properties of 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one has a molecular weight of 270.34 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one is sourced from PubChem (CID 4620890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).