(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide

CHIN6S — CID 156626467

IUPAC(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide
SMILESS=N/N=N/N=N/N=C/I
InChIInChI=1S/CHIN6S/c2-1-3-4-5-6-7-8-9/h1H/b3-1+,5-4+,7-6+
InChIKeyJFGRZMQMMUVTDH-ONBOPYQMSA-N
MW256.03 g/mol
LogP1.83
Rot. Bonds3

About (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide

(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide (PubChem CID 156626467) has the molecular formula CHIN6S and a molecular weight of 256.03 g/mol. Its IUPAC name is (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide.

Molecular Properties

Compound Name(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide
PubChem CID156626467
Molecular FormulaCHIN6S
Molecular Weight256.03 g/mol
Exact Mass255.90
IUPAC Name(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide
SMILESS=N/N=N/N=N/N=C/I
InChIInChI=1S/CHIN6S/c2-1-3-4-5-6-7-8-9/h1H/b3-1+,5-4+,7-6+
InChIKeyJFGRZMQMMUVTDH-ONBOPYQMSA-N
XLogP1.83
TPSA74.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.03
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[(aminodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]methanimidoyl iodide
CID 170514173
N-[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[[(aminodiazenyl)diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]methanimidoyl iodide
CID 170514191
(1Z)-N-(2-sulfanylethenylideneamino)methanimidoyl iodide
CID 176542936
(1Z)-N-[(E)-2-diazenylethylideneamino]methanimidoyl iodide
CID 90452887
(E)-1,2-dideuterio-1,2-diiodoethene
CID 167531325
N-(diphosphanyl)methanimidoyl iodide
CID 174126177
thionitrosophosphane
CID 158590900
CID 15387292
CID 15387292
N-[(Z)-1-(methylamino)prop-1-en-2-yl]methanimidoyl iodide
CID 118265366
N-[(benzylideneamino)-phenylcarbamothioyl]benzamide
CID 71388235
1,5-dibromopenta-1,4-dien-3-one
CID 54232728
N-[(E)-(4-methylsulfanylphenyl)methylideneamino]thiophene-2-carboxamide
CID 6878439

Frequently Asked Questions

What is the IUPAC name of (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide?
The IUPAC name of (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide (CID 156626467) is (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide.
What is the SMILES notation for (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide?
The canonical SMILES for (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide is S=N/N=N/N=N/N=C/I.
What is the InChIKey of (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide?
The InChIKey is JFGRZMQMMUVTDH-ONBOPYQMSA-N. The full InChI is InChI=1S/CHIN6S/c2-1-3-4-5-6-7-8-9/h1H/b3-1+,5-4+,7-6+.
What are the key properties of (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide?
(1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide has a molecular weight of 256.03 g/mol, XLogP of 1.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-N-[(E)-[(E)-thionitrosodiazenyl]diazenyl]methanimidoyl iodide is sourced from PubChem (CID 156626467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).