8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid

C7H5N3O3 — CID 117274056

IUPAC8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid
SMILESO=C(O)c1cn2cc[nH]c(=O)c2n1
InChIInChI=1S/C7H5N3O3/c11-6-5-9-4(7(12)13)3-10(5)2-1-8-6/h1-3H,(H,8,11)(H,12,13)
InChIKeyQQMLZKFKSUKHPF-UHFFFAOYSA-N
MW179.13 g/mol
LogP-0.28
Rot. Bonds1

About 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid

8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid (PubChem CID 117274056) has the molecular formula C7H5N3O3 and a molecular weight of 179.13 g/mol. Its IUPAC name is 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid
PubChem CID117274056
Molecular FormulaC7H5N3O3
Molecular Weight179.13 g/mol
Exact Mass179.03
IUPAC Name8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid
SMILESO=C(O)c1cn2cc[nH]c(=O)c2n1
InChIInChI=1S/C7H5N3O3/c11-6-5-9-4(7(12)13)3-10(5)2-1-8-6/h1-3H,(H,8,11)(H,12,13)
InChIKeyQQMLZKFKSUKHPF-UHFFFAOYSA-N
XLogP-0.28
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.13
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid?
The IUPAC name of 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid (CID 117274056) is 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid.
What is the SMILES notation for 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid?
The canonical SMILES for 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid is O=C(O)c1cn2cc[nH]c(=O)c2n1.
What is the InChIKey of 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid?
The InChIKey is QQMLZKFKSUKHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3O3/c11-6-5-9-4(7(12)13)3-10(5)2-1-8-6/h1-3H,(H,8,11)(H,12,13).
What are the key properties of 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid?
8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid has a molecular weight of 179.13 g/mol, XLogP of -0.28, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-oxo-7H-imidazo[1,2-a]pyrazine-2-carboxylic acid is sourced from PubChem (CID 117274056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).