1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid

C10H10N4O2 — CID 114476938

IUPAC1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid
SMILESCc1ncc(-n2cnc(C(=O)O)c2)nc1C
InChIInChI=1S/C10H10N4O2/c1-6-7(2)13-9(3-11-6)14-4-8(10(15)16)12-5-14/h3-5H,1-2H3,(H,15,16)
InChIKeyBWHYQOQGCYBUFH-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.98
Rot. Bonds2

About 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid

1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid (PubChem CID 114476938) has the molecular formula C10H10N4O2 and a molecular weight of 218.22 g/mol. Its IUPAC name is 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid.

Molecular Properties

Compound Name1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid
PubChem CID114476938
Molecular FormulaC10H10N4O2
Molecular Weight218.22 g/mol
Exact Mass218.08
IUPAC Name1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid
SMILESCc1ncc(-n2cnc(C(=O)O)c2)nc1C
InChIInChI=1S/C10H10N4O2/c1-6-7(2)13-9(3-11-6)14-4-8(10(15)16)12-5-14/h3-5H,1-2H3,(H,15,16)
InChIKeyBWHYQOQGCYBUFH-UHFFFAOYSA-N
XLogP0.98
TPSA80.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-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

Related Compounds

1-(3,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid
CID 65418211
1-(2-methylpyrimidin-4-yl)imidazole-4-carboxylic acid
CID 63343046
1-(3,5-dimethylphenyl)imidazole-4-carboxylic acid
CID 62057706
1-(4-methylpyrimidin-2-yl)imidazole-4-carboxylic acid
CID 63343224
1-(6-methylsulfanylpyrimidin-4-yl)imidazole-4-carboxylic acid
CID 106973539
1-(5-bromo-3-methyl-2-pyridinyl)imidazole-4-carboxylic acid
CID 79718030
1-(5-fluoropyrimidin-2-yl)imidazole-4-carboxylic acid
CID 104606538
1-(3,4-dimethylphenyl)imidazole-4-carboxylic acid
CID 23444996
1-(6-methylthieno[2,3-d]pyrimidin-4-yl)imidazole-4-carboxylic acid
CID 63617898
1-(6-ethyl-2-propan-2-ylpyrimidin-4-yl)imidazole-4-carboxylic acid
CID 94075538
1-pyrazolo[1,5-a]pyrimidin-5-ylimidazole-4-carboxylic acid
CID 115372957
1-(3-methyl-2-pyridinyl)imidazole-4-carboxylic acid
CID 63342828

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid?
The IUPAC name of 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid (CID 114476938) is 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid.
What is the SMILES notation for 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid?
The canonical SMILES for 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid is Cc1ncc(-n2cnc(C(=O)O)c2)nc1C.
What is the InChIKey of 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid?
The InChIKey is BWHYQOQGCYBUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2/c1-6-7(2)13-9(3-11-6)14-4-8(10(15)16)12-5-14/h3-5H,1-2H3,(H,15,16).
What are the key properties of 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid?
1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid has a molecular weight of 218.22 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dimethylpyrazin-2-yl)imidazole-4-carboxylic acid is sourced from PubChem (CID 114476938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).