potassium 2-[formyl(hydroxy)amino]acetic acid

C3H5KNO4+ — CID 54611881

IUPACpotassium 2-[formyl(hydroxy)amino]acetic acid
SMILESO=CN(O)CC(=O)O.[K+]
InChIInChI=1S/C3H5NO4.K/c5-2-4(8)1-3(6)7;/h2,8H,1H2,(H,6,7);/q;+1
InChIKeyBHXIALPKTFKQDX-UHFFFAOYSA-N
MW158.17 g/mol
LogP-4.08
Rot. Bonds3

About potassium 2-[formyl(hydroxy)amino]acetic acid

potassium 2-[formyl(hydroxy)amino]acetic acid (PubChem CID 54611881) has the molecular formula C3H5KNO4+ and a molecular weight of 158.17 g/mol. Its IUPAC name is potassium 2-[formyl(hydroxy)amino]acetic acid.

Molecular Properties

Compound Namepotassium 2-[formyl(hydroxy)amino]acetic acid
PubChem CID54611881
Molecular FormulaC3H5KNO4+
Molecular Weight158.17 g/mol
Exact Mass157.99
IUPAC Namepotassium 2-[formyl(hydroxy)amino]acetic acid
SMILESO=CN(O)CC(=O)O.[K+]
InChIInChI=1S/C3H5NO4.K/c5-2-4(8)1-3(6)7;/h2,8H,1H2,(H,6,7);/q;+1
InChIKeyBHXIALPKTFKQDX-UHFFFAOYSA-N
XLogP-4.08
TPSA77.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.17
LogP ≤ 5-4.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', '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 2-[formyl(hydroxy)amino]acetic acid?
The IUPAC name of potassium 2-[formyl(hydroxy)amino]acetic acid (CID 54611881) is potassium 2-[formyl(hydroxy)amino]acetic acid.
What is the SMILES notation for potassium 2-[formyl(hydroxy)amino]acetic acid?
The canonical SMILES for potassium 2-[formyl(hydroxy)amino]acetic acid is O=CN(O)CC(=O)O.[K+].
What is the InChIKey of potassium 2-[formyl(hydroxy)amino]acetic acid?
The InChIKey is BHXIALPKTFKQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO4.K/c5-2-4(8)1-3(6)7;/h2,8H,1H2,(H,6,7);/q;+1.
What are the key properties of potassium 2-[formyl(hydroxy)amino]acetic acid?
potassium 2-[formyl(hydroxy)amino]acetic acid has a molecular weight of 158.17 g/mol, XLogP of -4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-[formyl(hydroxy)amino]acetic acid is sourced from PubChem (CID 54611881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).