copper;azanide;ethylidene(dioxido)azanium;dihydrate

C2H10CuN2O4 — CID 134965461

IUPACcopper;azanide;ethylidene(dioxido)azanium;dihydrate
SMILESCC=[N+]([O-])[O-].O.O.[Cu+2].[NH2-]
InChIInChI=1S/C2H4NO2.Cu.H2N.2H2O/c1-2-3(4)5;;;;/h2H,1H3;;3*1H2/q-1;+2;-1;;
InChIKeyCQTFMSZDFICBFK-UHFFFAOYSA-N
MW189.66 g/mol
LogP-0.85
Rot. Bonds

About copper;azanide;ethylidene(dioxido)azanium;dihydrate

copper;azanide;ethylidene(dioxido)azanium;dihydrate (PubChem CID 134965461) has the molecular formula C2H10CuN2O4 and a molecular weight of 189.66 g/mol. Its IUPAC name is copper;azanide;ethylidene(dioxido)azanium;dihydrate.

Molecular Properties

Compound Namecopper;azanide;ethylidene(dioxido)azanium;dihydrate
PubChem CID134965461
Molecular FormulaC2H10CuN2O4
Molecular Weight189.66 g/mol
Exact Mass188.99
IUPAC Namecopper;azanide;ethylidene(dioxido)azanium;dihydrate
SMILESCC=[N+]([O-])[O-].O.O.[Cu+2].[NH2-]
InChIInChI=1S/C2H4NO2.Cu.H2N.2H2O/c1-2-3(4)5;;;;/h2H,1H3;;3*1H2/q-1;+2;-1;;
InChIKeyCQTFMSZDFICBFK-UHFFFAOYSA-N
XLogP-0.85
TPSA145.63 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.66
LogP ≤ 5-0.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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 copper;azanide;ethylidene(dioxido)azanium;dihydrate?
The IUPAC name of copper;azanide;ethylidene(dioxido)azanium;dihydrate (CID 134965461) is copper;azanide;ethylidene(dioxido)azanium;dihydrate.
What is the SMILES notation for copper;azanide;ethylidene(dioxido)azanium;dihydrate?
The canonical SMILES for copper;azanide;ethylidene(dioxido)azanium;dihydrate is CC=[N+]([O-])[O-].O.O.[Cu+2].[NH2-].
What is the InChIKey of copper;azanide;ethylidene(dioxido)azanium;dihydrate?
The InChIKey is CQTFMSZDFICBFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4NO2.Cu.H2N.2H2O/c1-2-3(4)5;;;;/h2H,1H3;;3*1H2/q-1;+2;-1;;.
What are the key properties of copper;azanide;ethylidene(dioxido)azanium;dihydrate?
copper;azanide;ethylidene(dioxido)azanium;dihydrate has a molecular weight of 189.66 g/mol, XLogP of -0.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;azanide;ethylidene(dioxido)azanium;dihydrate is sourced from PubChem (CID 134965461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).