N-hydroxyethanimidoyl iodide

C2H4INO — CID 173361883

IUPACN-hydroxyethanimidoyl iodide
SMILESCC(I)=NO
InChIInChI=1S/C2H4INO/c1-2(3)4-5/h5H,1H3
InChIKeyVUBPRKXVXOMEHJ-UHFFFAOYSA-N
MW184.96 g/mol
LogP1.23
Rot. Bonds

About N-hydroxyethanimidoyl iodide

N-hydroxyethanimidoyl iodide (PubChem CID 173361883) has the molecular formula C2H4INO and a molecular weight of 184.96 g/mol. Its IUPAC name is N-hydroxyethanimidoyl iodide.

Molecular Properties

Compound NameN-hydroxyethanimidoyl iodide
PubChem CID173361883
Molecular FormulaC2H4INO
Molecular Weight184.96 g/mol
Exact Mass184.93
IUPAC NameN-hydroxyethanimidoyl iodide
SMILESCC(I)=NO
InChIInChI=1S/C2H4INO/c1-2(3)4-5/h5H,1H3
InChIKeyVUBPRKXVXOMEHJ-UHFFFAOYSA-N
XLogP1.23
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.96
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxyethanimidoyl iodide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxyethanimidoyl iodide?
The IUPAC name of N-hydroxyethanimidoyl iodide (CID 173361883) is N-hydroxyethanimidoyl iodide.
What is the SMILES notation for N-hydroxyethanimidoyl iodide?
The canonical SMILES for N-hydroxyethanimidoyl iodide is CC(I)=NO.
What is the InChIKey of N-hydroxyethanimidoyl iodide?
The InChIKey is VUBPRKXVXOMEHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4INO/c1-2(3)4-5/h5H,1H3.
What are the key properties of N-hydroxyethanimidoyl iodide?
N-hydroxyethanimidoyl iodide has a molecular weight of 184.96 g/mol, XLogP of 1.23, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxyethanimidoyl iodide is sourced from PubChem (CID 173361883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).