3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione

C11H12N6O2 — CID 80856508

IUPAC3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(Nc2nc(N)cn3ccnc23)C1=O
InChIInChI=1S/C11H12N6O2/c1-16-8(18)4-6(11(16)19)14-9-10-13-2-3-17(10)5-7(12)15-9/h2-3,5-6H,4,12H2,1H3,(H,14,15)
InChIKeyVOVWHSXHCQTLJB-UHFFFAOYSA-N
MW260.26 g/mol
LogP-0.52
Rot. Bonds2

About 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione

3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione (PubChem CID 80856508) has the molecular formula C11H12N6O2 and a molecular weight of 260.26 g/mol. Its IUPAC name is 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione
PubChem CID80856508
Molecular FormulaC11H12N6O2
Molecular Weight260.26 g/mol
Exact Mass260.10
IUPAC Name3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione
SMILESCN1C(=O)CC(Nc2nc(N)cn3ccnc23)C1=O
InChIInChI=1S/C11H12N6O2/c1-16-8(18)4-6(11(16)19)14-9-10-13-2-3-17(10)5-7(12)15-9/h2-3,5-6H,4,12H2,1H3,(H,14,15)
InChIKeyVOVWHSXHCQTLJB-UHFFFAOYSA-N
XLogP-0.52
TPSA105.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

3-[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]-1-methylpyrrolidine-2,5-dione
CID 80831659
3-[(4-amino-1-methylpyrazol-3-yl)amino]-1-methylpyrrolidine-2,5-dione
CID 103078644
2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
CID 80827493
1-methyl-3-[[6-(propylamino)imidazo[1,2-a]pyrazin-8-yl]amino]pyrrolidin-2-one
CID 106258542
8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 113476564
8-N-(3-ethylpentan-3-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80841859
8-N-[(1-methylimidazol-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80829250
2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-N-cyclopropylacetamide
CID 80792658
methyl 2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]acetate
CID 80776875
3-[[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]amino]piperidine-2,6-dione
CID 80833133
8-N-[2-[cyclopropyl(methyl)amino]ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80824349
1-methyl-3-(1,3-thiazol-2-ylamino)pyrrolidine-2,5-dione
CID 43635903

Frequently Asked Questions

What is the IUPAC name of 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione?
The IUPAC name of 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione (CID 80856508) is 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione.
What is the SMILES notation for 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione?
The canonical SMILES for 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione is CN1C(=O)CC(Nc2nc(N)cn3ccnc23)C1=O.
What is the InChIKey of 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione?
The InChIKey is VOVWHSXHCQTLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O2/c1-16-8(18)4-6(11(16)19)14-9-10-13-2-3-17(10)5-7(12)15-9/h2-3,5-6H,4,12H2,1H3,(H,14,15).
What are the key properties of 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione?
3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione has a molecular weight of 260.26 g/mol, XLogP of -0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-1-methylpyrrolidine-2,5-dione is sourced from PubChem (CID 80856508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).