disodium bis(N-hydroxynitramide)

H4N4Na2O6+2 — CID 170923716

IUPACdisodium bis(N-hydroxynitramide)
SMILESO=[N+]([O-])NO.O=[N+]([O-])NO.[Na+].[Na+]
InChIInChI=1S/2H2N2O3.2Na/c2*3-1-2(4)5;;/h2*1,3H;;/q;;2*+1
InChIKeyGPCJLXDJKUJFTP-UHFFFAOYSA-N
MW202.03 g/mol
LogP-7.68
Rot. Bonds2

About disodium bis(N-hydroxynitramide)

disodium bis(N-hydroxynitramide) (PubChem CID 170923716) has the molecular formula H4N4Na2O6+2 and a molecular weight of 202.03 g/mol. Its IUPAC name is disodium bis(N-hydroxynitramide).

Molecular Properties

Compound Namedisodium bis(N-hydroxynitramide)
PubChem CID170923716
Molecular FormulaH4N4Na2O6+2
Molecular Weight202.03 g/mol
Exact Mass201.99
IUPAC Namedisodium bis(N-hydroxynitramide)
SMILESO=[N+]([O-])NO.O=[N+]([O-])NO.[Na+].[Na+]
InChIInChI=1S/2H2N2O3.2Na/c2*3-1-2(4)5;;/h2*1,3H;;/q;;2*+1
InChIKeyGPCJLXDJKUJFTP-UHFFFAOYSA-N
XLogP-7.68
TPSA150.80 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.03
LogP ≤ 5-7.68
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

azane;hydroxylamine;N-hydroxynitramide
CID 173388904
1,3-dinitrourea
CID 10866514
nitrocarbamic acid
CID 19704539
sodium;nitric hydrazide;hydroxide;hydrate
CID 174819631
sodium;hydride;N-methylnitramide
CID 173405848
disodium;nitric acid;sulfide
CID 162139753
sodium;hydride;nitric acid
CID 174891443
chloranium;sodium;dinitrate
CID 161429645
sodium;argon;nitrate
CID 174916471
sodium;iron(2+);trinitrate
CID 160556784
sodium;nitrate;tetrahydrate
CID 162201136
sodium;nitrate;decahydrate
CID 163206513

Frequently Asked Questions

What is the IUPAC name of disodium bis(N-hydroxynitramide)?
The IUPAC name of disodium bis(N-hydroxynitramide) (CID 170923716) is disodium bis(N-hydroxynitramide).
What is the SMILES notation for disodium bis(N-hydroxynitramide)?
The canonical SMILES for disodium bis(N-hydroxynitramide) is O=[N+]([O-])NO.O=[N+]([O-])NO.[Na+].[Na+].
What is the InChIKey of disodium bis(N-hydroxynitramide)?
The InChIKey is GPCJLXDJKUJFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/2H2N2O3.2Na/c2*3-1-2(4)5;;/h2*1,3H;;/q;;2*+1.
What are the key properties of disodium bis(N-hydroxynitramide)?
disodium bis(N-hydroxynitramide) has a molecular weight of 202.03 g/mol, XLogP of -7.68, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for disodium bis(N-hydroxynitramide) is sourced from PubChem (CID 170923716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).