dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate

C10H14Mg2N2O8+2 — CID 154706747

IUPACdimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate
SMILESO=C([O-])C[NH+](CC[NH+](CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Mg+2].[Mg+2]
InChIInChI=1S/C10H16N2O8.2Mg/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;/q;2*+2/p-2
InChIKeyIDXKSDJIIYUSQP-UHFFFAOYSA-L
MW338.84 g/mol
LogP-11.01
Rot. Bonds11

About dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate

dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate (PubChem CID 154706747) has the molecular formula C10H14Mg2N2O8+2 and a molecular weight of 338.84 g/mol. Its IUPAC name is dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate.

Molecular Properties

Compound Namedimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate
PubChem CID154706747
Molecular FormulaC10H14Mg2N2O8+2
Molecular Weight338.84 g/mol
Exact Mass338.04
IUPAC Namedimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate
SMILESO=C([O-])C[NH+](CC[NH+](CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Mg+2].[Mg+2]
InChIInChI=1S/C10H16N2O8.2Mg/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;/q;2*+2/p-2
InChIKeyIDXKSDJIIYUSQP-UHFFFAOYSA-L
XLogP-11.01
TPSA169.40 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.84
LogP ≤ 5-11.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-[bis(carboxylatomethyl)azaniumyl]heptanoate
CID 7367261
2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)azaniumyl]acetate
CID 25201827
2-[(2-amino-2-oxoethyl)-(carboxylatomethyl)azaniumyl]acetate
CID 7018168
2-[2-[2-[2-[bis(carboxylatomethyl)amino]ethoxy]ethoxy]ethyl-(carboxylatomethyl)azaniumyl]acetate
CID 51590996
tris(carboxymethyl)azanium acetate
CID 90094500
2-[bis[2-(2,6-dioxomorpholin-4-yl)ethyl]azaniumyl]acetate
CID 16760401
magnesium;2-hydroxyacetate;chloride
CID 18799087
magnesium;zinc;propanoate
CID 22462046
2-[diaminomethyl(methyl)azaniumyl]acetate
CID 163179412
magnesium hexanedioate
CID 24074
trimagnesium;bis(2-aminoacetate);dicarbonate
CID 173203788
magnesium;2-chloroacetate;chloride
CID 18003403

Frequently Asked Questions

What is the IUPAC name of dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate?
The IUPAC name of dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate (CID 154706747) is dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate.
What is the SMILES notation for dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate?
The canonical SMILES for dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate is O=C([O-])C[NH+](CC[NH+](CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Mg+2].[Mg+2].
What is the InChIKey of dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate?
The InChIKey is IDXKSDJIIYUSQP-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H16N2O8.2Mg/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;/q;2*+2/p-2.
What are the key properties of dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate?
dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate has a molecular weight of 338.84 g/mol, XLogP of -11.01, 11 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for dimagnesium;2-[2-[bis(carboxylatomethyl)azaniumyl]ethyl-(carboxylatomethyl)azaniumyl]acetate is sourced from PubChem (CID 154706747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).