potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine

C3H9KN6O4S — CID 174896931

IUPACpotassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.O=S(=O)(O)O.[H-].[K+]
InChIInChI=1S/C3H6N6.K.H2O4S.H/c4-1-7-2(5)9-3(6)8-1;;1-5(2,3)4;/h(H6,4,5,6,7,8,9);;(H2,1,2,3,4);/q;+1;;-1
InChIKeyPTPFLLCBISCISU-UHFFFAOYSA-N
MW264.31 g/mol
LogP-4.92
Rot. Bonds

About potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine

potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine (PubChem CID 174896931) has the molecular formula C3H9KN6O4S and a molecular weight of 264.31 g/mol. Its IUPAC name is potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Namepotassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine
PubChem CID174896931
Molecular FormulaC3H9KN6O4S
Molecular Weight264.31 g/mol
Exact Mass264.00
IUPAC Namepotassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.O=S(=O)(O)O.[H-].[K+]
InChIInChI=1S/C3H6N6.K.H2O4S.H/c4-1-7-2(5)9-3(6)8-1;;1-5(2,3)4;/h(H6,4,5,6,7,8,9);;(H2,1,2,3,4);/q;+1;;-1
InChIKeyPTPFLLCBISCISU-UHFFFAOYSA-N
XLogP-4.92
TPSA191.33 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 5-4.92
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

sulfuric acid;1,3,5-triazine-2,4,6-triamine
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1,3,5-triazine-2,4,6-triamine
CID 67592325
1,3,5-triazine-2,4,6-triamine
CID 67883493
dipotassium;hydride;sulfuric acid
CID 173242189
1,3,5-triazine-2,4,6-triamine
CID 22011128
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CID 174450453
CID 158808778
CID 158808778
carbonodithioic S,S-acid;1,3,5-triazine-2,4,6-triamine
CID 175196538
azane;carbonic acid;1,3,5-triazine-2,4,6-triamine
CID 174964625
potassium;hydride;hydrogen peroxide;sulfuric acid
CID 173028137
dipotassium;hydride;sulfuric acid;hydroxide
CID 174734918

Frequently Asked Questions

What is the IUPAC name of potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine (CID 174896931) is potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine is Nc1nc(N)nc(N)n1.O=S(=O)(O)O.[H-].[K+].
What is the InChIKey of potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine?
The InChIKey is PTPFLLCBISCISU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.K.H2O4S.H/c4-1-7-2(5)9-3(6)8-1;;1-5(2,3)4;/h(H6,4,5,6,7,8,9);;(H2,1,2,3,4);/q;+1;;-1.
What are the key properties of potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine?
potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine has a molecular weight of 264.31 g/mol, XLogP of -4.92, 0 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;sulfuric acid;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 174896931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).