[(2-hydroxyacetyl)oxyamino]azanium

C2H7N2O3+ — CID 20617652

IUPAC[(2-hydroxyacetyl)oxyamino]azanium
SMILES[NH3+]NOC(=O)CO
InChIInChI=1S/C2H6N2O3/c3-4-7-2(6)1-5/h4-5H,1,3H2/p+1
InChIKeyNUYYOEOMWFLYBF-UHFFFAOYSA-O
MW107.09 g/mol
LogP-2.82
Rot. Bonds2

About [(2-hydroxyacetyl)oxyamino]azanium

[(2-hydroxyacetyl)oxyamino]azanium (PubChem CID 20617652) has the molecular formula C2H7N2O3+ and a molecular weight of 107.09 g/mol. Its IUPAC name is [(2-hydroxyacetyl)oxyamino]azanium.

Molecular Properties

Compound Name[(2-hydroxyacetyl)oxyamino]azanium
PubChem CID20617652
Molecular FormulaC2H7N2O3+
Molecular Weight107.09 g/mol
Exact Mass107.05
IUPAC Name[(2-hydroxyacetyl)oxyamino]azanium
SMILES[NH3+]NOC(=O)CO
InChIInChI=1S/C2H6N2O3/c3-4-7-2(6)1-5/h4-5H,1,3H2/p+1
InChIKeyNUYYOEOMWFLYBF-UHFFFAOYSA-O
XLogP-2.82
TPSA86.20 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.09
LogP ≤ 5-2.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(carbamohydrazonoylamino) 2-hydroxyacetate
CID 91197727
CID 175508289
CID 175508289
(2-hydroxyacetyl)oxymethyl 2-hydroxyacetate;methane
CID 161332645
stibanyl 2-hydroxyacetate
CID 174289017
silyl 2-hydroxyacetate
CID 123398347
phosphanyl 2-hydroxyacetate
CID 58716328
disodium;hydride;2-(2-hydroxyacetyl)oxyacetic acid
CID 173165496
ethane-1,2-diol;2-(2-hydroxyacetyl)oxyethyl 2-hydroxyacetate;methane
CID 163645846
phosphono 2-hydroxyacetate
CID 22320969
nitro 2-hydroxyacetate
CID 141320086
2-(2-hydroxyacetyl)oxyethanesulfonic acid
CID 148547139
calcium;hydride;methyl 2-hydroxyethaneperoxoate
CID 175527433

Frequently Asked Questions

What is the IUPAC name of [(2-hydroxyacetyl)oxyamino]azanium?
The IUPAC name of [(2-hydroxyacetyl)oxyamino]azanium (CID 20617652) is [(2-hydroxyacetyl)oxyamino]azanium.
What is the SMILES notation for [(2-hydroxyacetyl)oxyamino]azanium?
The canonical SMILES for [(2-hydroxyacetyl)oxyamino]azanium is [NH3+]NOC(=O)CO.
What is the InChIKey of [(2-hydroxyacetyl)oxyamino]azanium?
The InChIKey is NUYYOEOMWFLYBF-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H6N2O3/c3-4-7-2(6)1-5/h4-5H,1,3H2/p+1.
What are the key properties of [(2-hydroxyacetyl)oxyamino]azanium?
[(2-hydroxyacetyl)oxyamino]azanium has a molecular weight of 107.09 g/mol, XLogP of -2.82, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-hydroxyacetyl)oxyamino]azanium is sourced from PubChem (CID 20617652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).