tris(2-aminoacetate);copper

C6H12CuN3O6-3 — CID 158701626

IUPACtris(2-aminoacetate);copper
SMILESNCC(=O)[O-].NCC(=O)[O-].NCC(=O)[O-].[Cu]
InChIInChI=1S/3C2H5NO2.Cu/c3*3-1-2(4)5;/h3*1,3H2,(H,4,5);/p-3
InChIKeyHQJFHXGSBWELMF-UHFFFAOYSA-K
MW285.72 g/mol
LogP-6.92
Rot. Bonds3

About tris(2-aminoacetate);copper

tris(2-aminoacetate);copper (PubChem CID 158701626) has the molecular formula C6H12CuN3O6-3 and a molecular weight of 285.72 g/mol. Its IUPAC name is tris(2-aminoacetate);copper.

Molecular Properties

Compound Nametris(2-aminoacetate);copper
PubChem CID158701626
Molecular FormulaC6H12CuN3O6-3
Molecular Weight285.72 g/mol
Exact Mass285.00
IUPAC Nametris(2-aminoacetate);copper
SMILESNCC(=O)[O-].NCC(=O)[O-].NCC(=O)[O-].[Cu]
InChIInChI=1S/3C2H5NO2.Cu/c3*3-1-2(4)5;/h3*1,3H2,(H,4,5);/p-3
InChIKeyHQJFHXGSBWELMF-UHFFFAOYSA-K
XLogP-6.92
TPSA198.45 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.72
LogP ≤ 5-6.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Related Compounds

2-aminoacetate;rubidium(1+)
CID 59119233
aluminum tris(2-aminoacetate)
CID 6452712
tetrakis(2-aminoacetate);cobalt(2+);nickel(2+)
CID 175457538
tetrakis(2-aminoacetate);zirconium(4+);hydrochloride
CID 173139995
trimagnesium;bis(2-aminoacetate);dicarbonate
CID 173203788
aluminum;tris(2-aminoacetate);tetrahydrochloride
CID 173183956
copper;bis(2-aminoacetate);hydrate
CID 139067245
trisodium;2-aminoacetate;diacetate
CID 20975811
2-aminoacetate;iron(3+);diacetate
CID 174987571
CID 173183203
CID 173183203
aluminum;heptakis(2-aminoacetate);zirconium(4+);tetrahydrate
CID 175035825
sodium;2-aminoacetate;chromium(3+);trichloride
CID 24848593

Frequently Asked Questions

What is the IUPAC name of tris(2-aminoacetate);copper?
The IUPAC name of tris(2-aminoacetate);copper (CID 158701626) is tris(2-aminoacetate);copper.
What is the SMILES notation for tris(2-aminoacetate);copper?
The canonical SMILES for tris(2-aminoacetate);copper is NCC(=O)[O-].NCC(=O)[O-].NCC(=O)[O-].[Cu].
What is the InChIKey of tris(2-aminoacetate);copper?
The InChIKey is HQJFHXGSBWELMF-UHFFFAOYSA-K. The full InChI is InChI=1S/3C2H5NO2.Cu/c3*3-1-2(4)5;/h3*1,3H2,(H,4,5);/p-3.
What are the key properties of tris(2-aminoacetate);copper?
tris(2-aminoacetate);copper has a molecular weight of 285.72 g/mol, XLogP of -6.92, 3 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-aminoacetate);copper is sourced from PubChem (CID 158701626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).