[cyano(nitroso)amino] hypoiodite

CIN3O2 — CID 166923687

IUPAC[cyano(nitroso)amino] hypoiodite
SMILESN#CN(N=O)OI
InChIInChI=1S/CIN3O2/c2-7-5(1-3)4-6
InChIKeyWCOVJGPYTGEZHS-UHFFFAOYSA-N
MW212.93 g/mol
LogP0.73
Rot. Bonds2

About [cyano(nitroso)amino] hypoiodite

[cyano(nitroso)amino] hypoiodite (PubChem CID 166923687) has the molecular formula CIN3O2 and a molecular weight of 212.93 g/mol. Its IUPAC name is [cyano(nitroso)amino] hypoiodite.

Molecular Properties

Compound Name[cyano(nitroso)amino] hypoiodite
PubChem CID166923687
Molecular FormulaCIN3O2
Molecular Weight212.93 g/mol
Exact Mass212.90
IUPAC Name[cyano(nitroso)amino] hypoiodite
SMILESN#CN(N=O)OI
InChIInChI=1S/CIN3O2/c2-7-5(1-3)4-6
InChIKeyWCOVJGPYTGEZHS-UHFFFAOYSA-N
XLogP0.73
TPSA65.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.93
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyanate_/aminonitrile_/thiocyanate', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-nitroso', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [cyano(nitroso)amino] hypoiodite with MolForge

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

Launch Full Analysis

Related Compounds

amino(nitroso)cyanamide
CID 86222366
dicyanocyanamide
CID 14849309
acetonitrile;nitrous acid
CID 159088551
acetonitrile;nitrous amide
CID 19755414
cyanamide;nitrous acid
CID 174714431
oxosilylformonitrile
CID 57376794
CID 5383435
CID 5383435
formaldehyde;rhenium;thiocyanate
CID 119097765
nitroso 2-cyanoacetate
CID 174813457
[cyano(methyl)amino] methyl carbonate
CID 89283667
2-ethoxy-2-nitrosoacetonitrile
CID 123676333
octanonacontasodium;thiocyanic acid
CID 173362917

Frequently Asked Questions

What is the IUPAC name of [cyano(nitroso)amino] hypoiodite?
The IUPAC name of [cyano(nitroso)amino] hypoiodite (CID 166923687) is [cyano(nitroso)amino] hypoiodite.
What is the SMILES notation for [cyano(nitroso)amino] hypoiodite?
The canonical SMILES for [cyano(nitroso)amino] hypoiodite is N#CN(N=O)OI.
What is the InChIKey of [cyano(nitroso)amino] hypoiodite?
The InChIKey is WCOVJGPYTGEZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/CIN3O2/c2-7-5(1-3)4-6.
What are the key properties of [cyano(nitroso)amino] hypoiodite?
[cyano(nitroso)amino] hypoiodite has a molecular weight of 212.93 g/mol, XLogP of 0.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [cyano(nitroso)amino] hypoiodite is sourced from PubChem (CID 166923687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).