About potassium;amino cyanate;hydride
potassium;amino cyanate;hydride (PubChem CID 174784610) has the molecular formula CH3KN2O
and a molecular weight of 98.15 g/mol. Its IUPAC name is potassium;amino cyanate;hydride.
Molecular Properties
| Compound Name | potassium;amino cyanate;hydride |
| PubChem CID | 174784610 |
| Molecular Formula | CH3KN2O |
| Molecular Weight | 98.15 g/mol |
| Exact Mass | 97.99 |
| IUPAC Name | potassium;amino cyanate;hydride |
| SMILES | N#CON.[H-].[K+] |
| InChI | InChI=1S/CH2N2O.K.H/c2-1-4-3;;/h3H2;;/q;+1;-1 |
| InChIKey | NPSSSQKNSRTQRD-UHFFFAOYSA-N |
| XLogP | -3.53 |
| TPSA | 59.04 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | |
| Heavy Atoms | 5 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 98.15 |
| LogP ≤ 5 | -3.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of potassium;amino cyanate;hydride?
The IUPAC name of potassium;amino cyanate;hydride (CID 174784610) is potassium;amino cyanate;hydride.
What is the SMILES notation for potassium;amino cyanate;hydride?
The canonical SMILES for potassium;amino cyanate;hydride is N#CON.[H-].[K+].
What is the InChIKey of potassium;amino cyanate;hydride?
The InChIKey is NPSSSQKNSRTQRD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2N2O.K.H/c2-1-4-3;;/h3H2;;/q;+1;-1.
What are the key properties of potassium;amino cyanate;hydride?
potassium;amino cyanate;hydride has a molecular weight of 98.15 g/mol, XLogP of -3.53, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;amino cyanate;hydride is sourced from PubChem (CID 174784610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).