tripotassium;amino methyl hydrogen phosphate;azane;hydride

CH12K3N2O4P — CID 174615874

IUPACtripotassium;amino methyl hydrogen phosphate;azane;hydride
SMILESCOP(=O)(O)ON.N.[H-].[H-].[H-].[K+].[K+].[K+]
InChIInChI=1S/CH6NO4P.3K.H3N.3H/c1-5-7(3,4)6-2;;;;;;;/h2H2,1H3,(H,3,4);;;;1H3;;;/q;3*+1;;3*-1
InChIKeyIXEZINSLEWRAPM-UHFFFAOYSA-N
MW264.38 g/mol
LogP-8.86
Rot. Bonds2

About tripotassium;amino methyl hydrogen phosphate;azane;hydride

tripotassium;amino methyl hydrogen phosphate;azane;hydride (PubChem CID 174615874) has the molecular formula CH12K3N2O4P and a molecular weight of 264.38 g/mol. Its IUPAC name is tripotassium;amino methyl hydrogen phosphate;azane;hydride.

Molecular Properties

Compound Nametripotassium;amino methyl hydrogen phosphate;azane;hydride
PubChem CID174615874
Molecular FormulaCH12K3N2O4P
Molecular Weight264.38 g/mol
Exact Mass263.94
IUPAC Nametripotassium;amino methyl hydrogen phosphate;azane;hydride
SMILESCOP(=O)(O)ON.N.[H-].[H-].[H-].[K+].[K+].[K+]
InChIInChI=1S/CH6NO4P.3K.H3N.3H/c1-5-7(3,4)6-2;;;;;;;/h2H2,1H3,(H,3,4);;;;1H3;;;/q;3*+1;;3*-1
InChIKeyIXEZINSLEWRAPM-UHFFFAOYSA-N
XLogP-8.86
TPSA116.78 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 5-8.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

sodium;azane;dimethyl hydrogen phosphate;hydride
CID 175474279
potassium;hydride;phosphoric acid;trimethyl phosphate
CID 174889020
tris(dimethyl hydrogen phosphate);titanium
CID 131876605
potassium;amino dihydrogen phosphate;hydride
CID 174393027
dipotassium;hydride;methyl dihydrogen phosphate
CID 174980148
dimethyl hydrogen phosphate;methane
CID 88807117
dimethyl hydrogen phosphate;heptahydrate
CID 175149976
azane;methyl phosphono hydrogen phosphate
CID 175124465
azane;dimethyl hydrogen phosphate;ethanol
CID 174156402
sodium;amino ethyl hydrogen phosphate;hydride
CID 173405948
azane;[hydroxy(methoxy)phosphoryl] dimethyl phosphate
CID 174777676
fluoro methyl hydrogen phosphate
CID 87128109

Frequently Asked Questions

What is the IUPAC name of tripotassium;amino methyl hydrogen phosphate;azane;hydride?
The IUPAC name of tripotassium;amino methyl hydrogen phosphate;azane;hydride (CID 174615874) is tripotassium;amino methyl hydrogen phosphate;azane;hydride.
What is the SMILES notation for tripotassium;amino methyl hydrogen phosphate;azane;hydride?
The canonical SMILES for tripotassium;amino methyl hydrogen phosphate;azane;hydride is COP(=O)(O)ON.N.[H-].[H-].[H-].[K+].[K+].[K+].
What is the InChIKey of tripotassium;amino methyl hydrogen phosphate;azane;hydride?
The InChIKey is IXEZINSLEWRAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/CH6NO4P.3K.H3N.3H/c1-5-7(3,4)6-2;;;;;;;/h2H2,1H3,(H,3,4);;;;1H3;;;/q;3*+1;;3*-1.
What are the key properties of tripotassium;amino methyl hydrogen phosphate;azane;hydride?
tripotassium;amino methyl hydrogen phosphate;azane;hydride has a molecular weight of 264.38 g/mol, XLogP of -8.86, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;amino methyl hydrogen phosphate;azane;hydride is sourced from PubChem (CID 174615874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).