potassium;3-formamidooxy-3-oxopropanoic acid;hydride

C4H6KNO5 — CID 174419070

IUPACpotassium;3-formamidooxy-3-oxopropanoic acid;hydride
SMILESO=CNOC(=O)CC(=O)O.[H-].[K+]
InChIInChI=1S/C4H5NO5.K.H/c6-2-5-10-4(9)1-3(7)8;;/h2H,1H2,(H,5,6)(H,7,8);;/q;+1;-1
InChIKeyYEJNJTIXTHZDGU-UHFFFAOYSA-N
MW187.19 g/mol
LogP-4.22
Rot. Bonds4

About potassium;3-formamidooxy-3-oxopropanoic acid;hydride

potassium;3-formamidooxy-3-oxopropanoic acid;hydride (PubChem CID 174419070) has the molecular formula C4H6KNO5 and a molecular weight of 187.19 g/mol. Its IUPAC name is potassium;3-formamidooxy-3-oxopropanoic acid;hydride.

Molecular Properties

Compound Namepotassium;3-formamidooxy-3-oxopropanoic acid;hydride
PubChem CID174419070
Molecular FormulaC4H6KNO5
Molecular Weight187.19 g/mol
Exact Mass186.99
IUPAC Namepotassium;3-formamidooxy-3-oxopropanoic acid;hydride
SMILESO=CNOC(=O)CC(=O)O.[H-].[K+]
InChIInChI=1S/C4H5NO5.K.H/c6-2-5-10-4(9)1-3(7)8;;/h2H,1H2,(H,5,6)(H,7,8);;/q;+1;-1
InChIKeyYEJNJTIXTHZDGU-UHFFFAOYSA-N
XLogP-4.22
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 5-4.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

sodium;formamido propanoate;hydride
CID 174830035
formamido pentanoate
CID 88804872
formamido 2-cyclopentylacetate
CID 155211748
3-(2-carboxyacetyl)peroxy-3-oxopropanoic acid
CID 175368500
lithium;potassium;hydride;3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid
CID 174967926
CID 170520162
CID 170520162
ethane;3-methoxy-3-oxopropanoic acid
CID 91567189
acetic acid;3-methoxy-3-oxopropanoic acid
CID 162325440
formamido but-2-enoate
CID 141290762
3-(2-ethylbutanoylamino)oxy-3-oxopropanoic acid
CID 53423618
strontium;hydride;propanedioic acid;hydrate
CID 173080551
3-(dihydroxymethoxy)-3-oxopropanoic acid
CID 87524206

Frequently Asked Questions

What is the IUPAC name of potassium;3-formamidooxy-3-oxopropanoic acid;hydride?
The IUPAC name of potassium;3-formamidooxy-3-oxopropanoic acid;hydride (CID 174419070) is potassium;3-formamidooxy-3-oxopropanoic acid;hydride.
What is the SMILES notation for potassium;3-formamidooxy-3-oxopropanoic acid;hydride?
The canonical SMILES for potassium;3-formamidooxy-3-oxopropanoic acid;hydride is O=CNOC(=O)CC(=O)O.[H-].[K+].
What is the InChIKey of potassium;3-formamidooxy-3-oxopropanoic acid;hydride?
The InChIKey is YEJNJTIXTHZDGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO5.K.H/c6-2-5-10-4(9)1-3(7)8;;/h2H,1H2,(H,5,6)(H,7,8);;/q;+1;-1.
What are the key properties of potassium;3-formamidooxy-3-oxopropanoic acid;hydride?
potassium;3-formamidooxy-3-oxopropanoic acid;hydride has a molecular weight of 187.19 g/mol, XLogP of -4.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;3-formamidooxy-3-oxopropanoic acid;hydride is sourced from PubChem (CID 174419070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).