copper;nitroxyl

HCuNO — CID 161404672

IUPACcopper;nitroxyl
SMILESN=O.[Cu]
InChIInChI=1S/Cu.HNO/c;1-2/h;1H
InChIKeyVURKTKHHTUWVPW-UHFFFAOYSA-N
MW94.56 g/mol
LogP0.33
Rot. Bonds

About copper;nitroxyl

copper;nitroxyl (PubChem CID 161404672) has the molecular formula HCuNO and a molecular weight of 94.56 g/mol. Its IUPAC name is copper;nitroxyl.

Molecular Properties

Compound Namecopper;nitroxyl
PubChem CID161404672
Molecular FormulaHCuNO
Molecular Weight94.56 g/mol
Exact Mass93.94
IUPAC Namecopper;nitroxyl
SMILESN=O.[Cu]
InChIInChI=1S/Cu.HNO/c;1-2/h;1H
InChIKeyVURKTKHHTUWVPW-UHFFFAOYSA-N
XLogP0.33
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.56
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of copper;nitroxyl?
The IUPAC name of copper;nitroxyl (CID 161404672) is copper;nitroxyl.
What is the SMILES notation for copper;nitroxyl?
The canonical SMILES for copper;nitroxyl is N=O.[Cu].
What is the InChIKey of copper;nitroxyl?
The InChIKey is VURKTKHHTUWVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/Cu.HNO/c;1-2/h;1H.
What are the key properties of copper;nitroxyl?
copper;nitroxyl has a molecular weight of 94.56 g/mol, XLogP of 0.33, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;nitroxyl is sourced from PubChem (CID 161404672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).