3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid

C7H7N3O4 — CID 12619142

IUPAC3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid
SMILESCc1nc(C(N)=O)c(C(=O)O)[nH]c1=O
InChIInChI=1S/C7H7N3O4/c1-2-6(12)10-4(7(13)14)3(9-2)5(8)11/h1H3,(H2,8,11)(H,10,12)(H,13,14)
InChIKeyYZFCKEGMMCYBTG-UHFFFAOYSA-N
MW197.15 g/mol
LogP-1.12
Rot. Bonds2

About 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid

3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid (PubChem CID 12619142) has the molecular formula C7H7N3O4 and a molecular weight of 197.15 g/mol. Its IUPAC name is 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid.

Molecular Properties

Compound Name3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid
PubChem CID12619142
Molecular FormulaC7H7N3O4
Molecular Weight197.15 g/mol
Exact Mass197.04
IUPAC Name3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid
SMILESCc1nc(C(N)=O)c(C(=O)O)[nH]c1=O
InChIInChI=1S/C7H7N3O4/c1-2-6(12)10-4(7(13)14)3(9-2)5(8)11/h1H3,(H2,8,11)(H,10,12)(H,13,14)
InChIKeyYZFCKEGMMCYBTG-UHFFFAOYSA-N
XLogP-1.12
TPSA126.14 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.15
LogP ≤ 5-1.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-carbamoyl-5-methyl-6-oxo-1H-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

Related Compounds

3,5-dimethyl-6-oxo-1H-pyrazine-2-carboxamide
CID 143824989
3-carbamoyl-6-oxo-1H-pyrazine-2-carboxylic acid
CID 12619134
2-bromo-1H-imidazole-4,5-dicarboxamide
CID 102460611
2-acetyl-1H-imidazole-4,5-dicarboxamide
CID 101076456
3,6-dimethylpyrazine-2,5-dicarboxylic acid;dihydrochloride
CID 70617975
3-methyl-5-oxo-4H-1,2,4-triazine-6-carboxylic acid
CID 135905248
5-(aminomethyl)-3-methyl-6-oxo-1H-pyridine-2-carboxylic acid
CID 82407952
5-hydroxy-2-(2-methyl-1H-imidazol-5-yl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 137128638
2-tert-butyl-4-methyl-6-oxo-1H-pyrimidine-5-carboxylic acid
CID 135881426
3,6-dimethyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide
CID 141072149
2-(2,4-dimethylphenyl)-1H-imidazole-4,5-dicarboxamide
CID 91091221
5-carbamoyl-2,6-dimethyl-4-oxo-1H-pyridine-3-carboxylic acid
CID 164905034

Frequently Asked Questions

What is the IUPAC name of 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid?
The IUPAC name of 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid (CID 12619142) is 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid.
What is the SMILES notation for 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid?
The canonical SMILES for 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid is Cc1nc(C(N)=O)c(C(=O)O)[nH]c1=O.
What is the InChIKey of 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid?
The InChIKey is YZFCKEGMMCYBTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O4/c1-2-6(12)10-4(7(13)14)3(9-2)5(8)11/h1H3,(H2,8,11)(H,10,12)(H,13,14).
What are the key properties of 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid?
3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid has a molecular weight of 197.15 g/mol, XLogP of -1.12, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbamoyl-5-methyl-6-oxo-1H-pyrazine-2-carboxylic acid is sourced from PubChem (CID 12619142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).