potassium;azane;(carbamoylamino) hydrogen phosphate

CH7KN3O5P — CID 173033502

IUPACpotassium;azane;(carbamoylamino) hydrogen phosphate
SMILESN.NC(=O)NOP(=O)([O-])O.[K+]
InChIInChI=1S/CH5N2O5P.K.H3N/c2-1(4)3-8-9(5,6)7;;/h(H3,2,3,4)(H2,5,6,7);;1H3/q;+1;/p-1
InChIKeyLUZOZJBNGJTDGT-UHFFFAOYSA-M
MW211.16 g/mol
LogP-4.79
Rot. Bonds2

About potassium;azane;(carbamoylamino) hydrogen phosphate

potassium;azane;(carbamoylamino) hydrogen phosphate (PubChem CID 173033502) has the molecular formula CH7KN3O5P and a molecular weight of 211.16 g/mol. Its IUPAC name is potassium;azane;(carbamoylamino) hydrogen phosphate.

Molecular Properties

Compound Namepotassium;azane;(carbamoylamino) hydrogen phosphate
PubChem CID173033502
Molecular FormulaCH7KN3O5P
Molecular Weight211.16 g/mol
Exact Mass210.98
IUPAC Namepotassium;azane;(carbamoylamino) hydrogen phosphate
SMILESN.NC(=O)NOP(=O)([O-])O.[K+]
InChIInChI=1S/CH5N2O5P.K.H3N/c2-1(4)3-8-9(5,6)7;;/h(H3,2,3,4)(H2,5,6,7);;1H3/q;+1;/p-1
InChIKeyLUZOZJBNGJTDGT-UHFFFAOYSA-M
XLogP-4.79
TPSA159.71 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.16
LogP ≤ 5-4.79
H-Bond Donors ≤ 54
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

(carbamoylamino) dihydrogen phosphate
CID 57166645
calcium;(carbamoylamino) dihydrogen phosphate;hydride
CID 174794856
amino (carbamoylamino) hydrogen phosphate
CID 174817337
azane;carbamoyl(hydroxy)phosphinate;hydron
CID 173454240
dipotassium;phosphonatoformamide
CID 141369742
sodium amino hydrogen phosphate
CID 175411495
dipotassium;azane;phosphoric acid;urea;sulfate
CID 173276292
bis(carbamoylamino) propyl phosphate
CID 88818411
phosphoric acid;sulfanylurea
CID 118224142
[amino-(carbamoylamino)methylidene]azanium;fluoro(hydroxy)phosphinate
CID 139061263
azane;cadmium(2+);hydrogen phosphate
CID 170850402
dipotassium;bis(dihydrogen phosphate);phosphoric acid
CID 19756002

Frequently Asked Questions

What is the IUPAC name of potassium;azane;(carbamoylamino) hydrogen phosphate?
The IUPAC name of potassium;azane;(carbamoylamino) hydrogen phosphate (CID 173033502) is potassium;azane;(carbamoylamino) hydrogen phosphate.
What is the SMILES notation for potassium;azane;(carbamoylamino) hydrogen phosphate?
The canonical SMILES for potassium;azane;(carbamoylamino) hydrogen phosphate is N.NC(=O)NOP(=O)([O-])O.[K+].
What is the InChIKey of potassium;azane;(carbamoylamino) hydrogen phosphate?
The InChIKey is LUZOZJBNGJTDGT-UHFFFAOYSA-M. The full InChI is InChI=1S/CH5N2O5P.K.H3N/c2-1(4)3-8-9(5,6)7;;/h(H3,2,3,4)(H2,5,6,7);;1H3/q;+1;/p-1.
What are the key properties of potassium;azane;(carbamoylamino) hydrogen phosphate?
potassium;azane;(carbamoylamino) hydrogen phosphate has a molecular weight of 211.16 g/mol, XLogP of -4.79, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;azane;(carbamoylamino) hydrogen phosphate is sourced from PubChem (CID 173033502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).