magnesium;2-aminoacetic acid;diacetate

C6H11MgNO6 — CID 172709967

IUPACmagnesium;2-aminoacetic acid;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].NCC(=O)O.[Mg+2]
InChIInChI=1S/C2H5NO2.2C2H4O2.Mg/c3-1-2(4)5;2*1-2(3)4;/h1,3H2,(H,4,5);2*1H3,(H,3,4);/q;;;+2/p-2
InChIKeyFCPXGQYSEJFCGW-UHFFFAOYSA-L
MW217.46 g/mol
LogP-3.84
Rot. Bonds1

About magnesium;2-aminoacetic acid;diacetate

magnesium;2-aminoacetic acid;diacetate (PubChem CID 172709967) has the molecular formula C6H11MgNO6 and a molecular weight of 217.46 g/mol. Its IUPAC name is magnesium;2-aminoacetic acid;diacetate.

Molecular Properties

Compound Namemagnesium;2-aminoacetic acid;diacetate
PubChem CID172709967
Molecular FormulaC6H11MgNO6
Molecular Weight217.46 g/mol
Exact Mass217.04
IUPAC Namemagnesium;2-aminoacetic acid;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].NCC(=O)O.[Mg+2]
InChIInChI=1S/C2H5NO2.2C2H4O2.Mg/c3-1-2(4)5;2*1-2(3)4;/h1,3H2,(H,4,5);2*1H3,(H,3,4);/q;;;+2/p-2
InChIKeyFCPXGQYSEJFCGW-UHFFFAOYSA-L
XLogP-3.84
TPSA143.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.46
LogP ≤ 5-3.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-aminoacetate;2-aminoacetic acid;copper(1+)
CID 156597297
acetic acid;2-aminoacetic acid;azane
CID 175048501
2-aminoacetate;iron(3+);diacetate
CID 174987571
trisodium;2-aminoacetate;diacetate
CID 20975811
disodium;2-aminoacetate;2-aminoacetic acid;methanol
CID 174881838
disodium;2-aminoacetic acid;hydrogen carbonate;hydroxide
CID 174055066
2-aminoacetic acid;ethanamine
CID 162171079
trimagnesium;bis(2-aminoacetate);dicarbonate
CID 173203788
2-aminoacetic acid;cadmium
CID 87269769
bis(2-aminoacetic acid);copper
CID 50912486
(2-aminoacetic acid);carbonic acid
CID 173312624
disodium;acetic acid;ethane-1,2-diamine;diacetate
CID 91971119

Frequently Asked Questions

What is the IUPAC name of magnesium;2-aminoacetic acid;diacetate?
The IUPAC name of magnesium;2-aminoacetic acid;diacetate (CID 172709967) is magnesium;2-aminoacetic acid;diacetate.
What is the SMILES notation for magnesium;2-aminoacetic acid;diacetate?
The canonical SMILES for magnesium;2-aminoacetic acid;diacetate is CC(=O)[O-].CC(=O)[O-].NCC(=O)O.[Mg+2].
What is the InChIKey of magnesium;2-aminoacetic acid;diacetate?
The InChIKey is FCPXGQYSEJFCGW-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H5NO2.2C2H4O2.Mg/c3-1-2(4)5;2*1-2(3)4;/h1,3H2,(H,4,5);2*1H3,(H,3,4);/q;;;+2/p-2.
What are the key properties of magnesium;2-aminoacetic acid;diacetate?
magnesium;2-aminoacetic acid;diacetate has a molecular weight of 217.46 g/mol, XLogP of -3.84, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;2-aminoacetic acid;diacetate is sourced from PubChem (CID 172709967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).