N-(2-hydroxyiminoethylidene)hydroxylamine

C2H4N2O2 — CID 135495951

IUPACN-(2-hydroxyiminoethylidene)hydroxylamine
SMILESON=CC=NO
InChIInChI=1S/C2H4N2O2/c5-3-1-2-4-6/h1-2,5-6H
InChIKeyLJHFIVQEAFAURQ-UHFFFAOYSA-N
MW88.07 g/mol
LogP-0.09
Rot. Bonds1

About N-(2-hydroxyiminoethylidene)hydroxylamine

N-(2-hydroxyiminoethylidene)hydroxylamine (PubChem CID 135495951) has the molecular formula C2H4N2O2 and a molecular weight of 88.07 g/mol. Its IUPAC name is N-(2-hydroxyiminoethylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-hydroxyiminoethylidene)hydroxylamine
PubChem CID135495951
Molecular FormulaC2H4N2O2
Molecular Weight88.07 g/mol
Exact Mass88.03
IUPAC NameN-(2-hydroxyiminoethylidene)hydroxylamine
SMILESON=CC=NO
InChIInChI=1S/C2H4N2O2/c5-3-1-2-4-6/h1-2,5-6H
InChIKeyLJHFIVQEAFAURQ-UHFFFAOYSA-N
XLogP-0.09
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.07
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 N-(2-hydroxyiminoethylidene)hydroxylamine?
The IUPAC name of N-(2-hydroxyiminoethylidene)hydroxylamine (CID 135495951) is N-(2-hydroxyiminoethylidene)hydroxylamine.
What is the SMILES notation for N-(2-hydroxyiminoethylidene)hydroxylamine?
The canonical SMILES for N-(2-hydroxyiminoethylidene)hydroxylamine is ON=CC=NO.
What is the InChIKey of N-(2-hydroxyiminoethylidene)hydroxylamine?
The InChIKey is LJHFIVQEAFAURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4N2O2/c5-3-1-2-4-6/h1-2,5-6H.
What are the key properties of N-(2-hydroxyiminoethylidene)hydroxylamine?
N-(2-hydroxyiminoethylidene)hydroxylamine has a molecular weight of 88.07 g/mol, XLogP of -0.09, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyiminoethylidene)hydroxylamine is sourced from PubChem (CID 135495951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).