N-(2-iminoethyl)hydroxylamine

C2H6N2O — CID 56627466

IUPACN-(2-iminoethyl)hydroxylamine
SMILES[H]/N=C/CNO
InChIInChI=1S/C2H6N2O/c3-1-2-4-5/h1,3-5H,2H2/b3-1+
InChIKeyDWEQAAHMNMOPSQ-HNQUOIGGSA-N
MW74.08 g/mol
LogP-0.39
Rot. Bonds2

About N-(2-iminoethyl)hydroxylamine

N-(2-iminoethyl)hydroxylamine (PubChem CID 56627466) has the molecular formula C2H6N2O and a molecular weight of 74.08 g/mol. Its IUPAC name is N-(2-iminoethyl)hydroxylamine.

Molecular Properties

Compound NameN-(2-iminoethyl)hydroxylamine
PubChem CID56627466
Molecular FormulaC2H6N2O
Molecular Weight74.08 g/mol
Exact Mass74.05
IUPAC NameN-(2-iminoethyl)hydroxylamine
SMILES[H]/N=C/CNO
InChIInChI=1S/C2H6N2O/c3-1-2-4-5/h1,3-5H,2H2/b3-1+
InChIKeyDWEQAAHMNMOPSQ-HNQUOIGGSA-N
XLogP-0.39
TPSA56.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.08
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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 N-(2-iminoethyl)hydroxylamine?
The IUPAC name of N-(2-iminoethyl)hydroxylamine (CID 56627466) is N-(2-iminoethyl)hydroxylamine.
What is the SMILES notation for N-(2-iminoethyl)hydroxylamine?
The canonical SMILES for N-(2-iminoethyl)hydroxylamine is [H]/N=C/CNO.
What is the InChIKey of N-(2-iminoethyl)hydroxylamine?
The InChIKey is DWEQAAHMNMOPSQ-HNQUOIGGSA-N. The full InChI is InChI=1S/C2H6N2O/c3-1-2-4-5/h1,3-5H,2H2/b3-1+.
What are the key properties of N-(2-iminoethyl)hydroxylamine?
N-(2-iminoethyl)hydroxylamine has a molecular weight of 74.08 g/mol, XLogP of -0.39, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iminoethyl)hydroxylamine is sourced from PubChem (CID 56627466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).