5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one

C12H14N6O2 — CID 64582319

IUPAC5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one
SMILESNc1ccc(=O)n(CC(=O)N2CCn3cnnc3C2)c1
InChIInChI=1S/C12H14N6O2/c13-9-1-2-11(19)18(5-9)7-12(20)16-3-4-17-8-14-15-10(17)6-16/h1-2,5,8H,3-4,6-7,13H2
InChIKeyMIBBURCPLYCJER-UHFFFAOYSA-N
MW274.28 g/mol
LogP-0.94
Rot. Bonds2

About 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one

5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one (PubChem CID 64582319) has the molecular formula C12H14N6O2 and a molecular weight of 274.28 g/mol. Its IUPAC name is 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one
PubChem CID64582319
Molecular FormulaC12H14N6O2
Molecular Weight274.28 g/mol
Exact Mass274.12
IUPAC Name5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one
SMILESNc1ccc(=O)n(CC(=O)N2CCn3cnnc3C2)c1
InChIInChI=1S/C12H14N6O2/c13-9-1-2-11(19)18(5-9)7-12(20)16-3-4-17-8-14-15-10(17)6-16/h1-2,5,8H,3-4,6-7,13H2
InChIKeyMIBBURCPLYCJER-UHFFFAOYSA-N
XLogP-0.94
TPSA99.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 5-0.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(8R)-8-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-1H-pyridin-2-one
CID 71550466
6-[(8S)-8-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-1H-pyridin-2-one
CID 71550467
1-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)but-2-en-1-one
CID 78954887
6-(8-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)-1H-pyridin-2-one
CID 89488479
N-[N-[(Z)-1-(4-cyclopropyl-1,2,4-triazol-3-yl)prop-1-enyl]-C-methylcarbonimidoyl]-4-(4-ethyl-3-oxopiperazin-1-yl)-1-methyl-2H-pyridine-6-carboxamide
CID 166691026
3-(3-methyl-1,2,4-triazol-1-yl)-1H-pyridin-2-one
CID 168934812
2-(5-amino-2-oxo-1-pyridinyl)-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 55118532
2-(5-amino-2-oxo-1-pyridinyl)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]acetamide
CID 55118579
5-Amino-1-[2-(3,5-dimethyl-1,2,4-triazol-1-yl)ethyl]pyridin-2-one
CID 61346519
2-[[(4-Methyl-1,2,4-triazol-3-yl)methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 62671071
2-(5-amino-2-oxo-1-pyridinyl)-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 62816720
1-[2-(5-Amino-2-oxo-1-pyridinyl)ethyl]-1,2,4-triazole-3-carbonitrile
CID 62951402

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one (CID 64582319) is 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one is Nc1ccc(=O)n(CC(=O)N2CCn3cnnc3C2)c1.
What is the InChIKey of 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one?
The InChIKey is MIBBURCPLYCJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O2/c13-9-1-2-11(19)18(5-9)7-12(20)16-3-4-17-8-14-15-10(17)6-16/h1-2,5,8H,3-4,6-7,13H2.
What are the key properties of 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one?
5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one has a molecular weight of 274.28 g/mol, XLogP of -0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 64582319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).