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

C11H10N4O — CID 2160998

IUPAC3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
SMILESNC1=NCc2nc3ccccc3c(=O)n2C1
InChIInChI=1S/C11H10N4O/c12-9-6-15-10(5-13-9)14-8-4-2-1-3-7(8)11(15)16/h1-4H,5-6H2,(H2,12,13)
InChIKeyCGVRFFUJYXEKKK-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.27
Rot. Bonds

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

3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one (PubChem CID 2160998) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one.

Molecular Properties

Compound Name3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
PubChem CID2160998
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
SMILESNC1=NCc2nc3ccccc3c(=O)n2C1
InChIInChI=1S/C11H10N4O/c12-9-6-15-10(5-13-9)14-8-4-2-1-3-7(8)11(15)16/h1-4H,5-6H2,(H2,12,13)
InChIKeyCGVRFFUJYXEKKK-UHFFFAOYSA-N
XLogP0.27
TPSA73.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-ethyl-3-ethylimino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one
CID 4620890
3-(hydroxymethylidene)-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one
CID 604015
8,9-dihydro-7H-pyrido[2,1-b]quinazoline-6,11-dione
CID 11275922
3-amino-2H-[1,3,4]thiadiazino[2,3-b]quinazolin-6-one
CID 18592735
3,4-dihydro-2H-[1,3]oxazino[2,3-b]quinazolin-6-one
CID 13381483
(3R)-3-hydroxy-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one
CID 776133
3-[(6-methyl-2-pyridinyl)methyl]-1,2,4,5-tetrahydro-[1,4]diazepino[7,1-b]quinazolin-11-one
CID 92561628
2-(aminomethyl)-3-methylquinazolin-4-one;hydrochloride
CID 75537334
4H-pyrazino[2,1-b]quinazoline-3,6-dione;2,2,2-trifluoroacetic acid
CID 172864968
9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-3-carbaldehyde
CID 13171281
(1S,14S)-17-(cyclopropanecarbonyl)-3,11,17-triazatetracyclo[12.2.1.03,12.05,10]heptadeca-5,7,9,11-tetraen-4-one
CID 98058425
3-amino-4-benzyl-4,5,10,18-tetrazatetracyclo[8.8.0.02,6.012,17]octadeca-1(18),2,5,12,14,16-hexaen-11-one
CID 3405757

Frequently Asked Questions

What is the IUPAC name of 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The IUPAC name of 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one (CID 2160998) is 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one.
What is the SMILES notation for 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The canonical SMILES for 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one is NC1=NCc2nc3ccccc3c(=O)n2C1.
What is the InChIKey of 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
The InChIKey is CGVRFFUJYXEKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c12-9-6-15-10(5-13-9)14-8-4-2-1-3-7(8)11(15)16/h1-4H,5-6H2,(H2,12,13).
What are the key properties of 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one?
3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one has a molecular weight of 214.23 g/mol, XLogP of 0.27, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1,4-dihydropyrazino[2,1-b]quinazolin-6-one is sourced from PubChem (CID 2160998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).