potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride

C4H4KN3O4 — CID 173141373

IUPACpotassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride
SMILESO=C(O)c1nc(=O)[nH]c(=O)[nH]1.[H-].[K+]
InChIInChI=1S/C4H3N3O4.K.H/c8-2(9)1-5-3(10)7-4(11)6-1;;/h(H,8,9)(H2,5,6,7,10,11);;/q;+1;-1
InChIKeyCJXXDGJHYITBOO-UHFFFAOYSA-N
MW197.19 g/mol
LogP-4.73
Rot. Bonds1

About potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride

potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride (PubChem CID 173141373) has the molecular formula C4H4KN3O4 and a molecular weight of 197.19 g/mol. Its IUPAC name is potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride.

Molecular Properties

Compound Namepotassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride
PubChem CID173141373
Molecular FormulaC4H4KN3O4
Molecular Weight197.19 g/mol
Exact Mass196.98
IUPAC Namepotassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride
SMILESO=C(O)c1nc(=O)[nH]c(=O)[nH]1.[H-].[K+]
InChIInChI=1S/C4H3N3O4.K.H/c8-2(9)1-5-3(10)7-4(11)6-1;;/h(H,8,9)(H2,5,6,7,10,11);;/q;+1;-1
InChIKeyCJXXDGJHYITBOO-UHFFFAOYSA-N
XLogP-4.73
TPSA115.91 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-4.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride 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 potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride?
The IUPAC name of potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride (CID 173141373) is potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride.
What is the SMILES notation for potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride?
The canonical SMILES for potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride is O=C(O)c1nc(=O)[nH]c(=O)[nH]1.[H-].[K+].
What is the InChIKey of potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride?
The InChIKey is CJXXDGJHYITBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3N3O4.K.H/c8-2(9)1-5-3(10)7-4(11)6-1;;/h(H,8,9)(H2,5,6,7,10,11);;/q;+1;-1.
What are the key properties of potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride?
potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride has a molecular weight of 197.19 g/mol, XLogP of -4.73, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;4,6-dioxo-1H-1,3,5-triazine-2-carboxylic acid;hydride is sourced from PubChem (CID 173141373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).