N-[(Z)-benzylideneamino]sulfamoyl iodide

C7H7IN2O2S — CID 129147769

IUPACN-[(Z)-benzylideneamino]sulfamoyl iodide
SMILESO=S(=O)(I)N/N=C\c1ccccc1
InChIInChI=1S/C7H7IN2O2S/c8-13(11,12)10-9-6-7-4-2-1-3-5-7/h1-6,10H/b9-6-
InChIKeyIIGDOITZCFISTM-TWGQIWQCSA-N
MW310.12 g/mol
LogP1.29
Rot. Bonds3

About N-[(Z)-benzylideneamino]sulfamoyl iodide

N-[(Z)-benzylideneamino]sulfamoyl iodide (PubChem CID 129147769) has the molecular formula C7H7IN2O2S and a molecular weight of 310.12 g/mol. Its IUPAC name is N-[(Z)-benzylideneamino]sulfamoyl iodide.

Molecular Properties

Compound NameN-[(Z)-benzylideneamino]sulfamoyl iodide
PubChem CID129147769
Molecular FormulaC7H7IN2O2S
Molecular Weight310.12 g/mol
Exact Mass309.93
IUPAC NameN-[(Z)-benzylideneamino]sulfamoyl iodide
SMILESO=S(=O)(I)N/N=C\c1ccccc1
InChIInChI=1S/C7H7IN2O2S/c8-13(11,12)10-9-6-7-4-2-1-3-5-7/h1-6,10H/b9-6-
InChIKeyIIGDOITZCFISTM-TWGQIWQCSA-N
XLogP1.29
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.12
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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-[(Z)-benzylideneamino]-4-[2-[4-[[(Z)-benzylideneamino]sulfamoyl]phenyl]ethyl]benzenesulfonamide
CID 125114108
N-[(Z)-(4-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 135641596
N-[(Z)-(4-methylphenyl)methylideneamino]benzenesulfonamide
CID 5387407
N-[(Z)-benzylideneamino]-2,5-dichlorobenzenesulfonamide
CID 5406662
4-methyl-N-[(E)-[4-[(E)-2-phenylethenyl]phenyl]methylideneamino]benzenesulfonamide
CID 162516902
N-[[4-(dimethylamino)phenyl]methylideneamino]benzenesulfonamide
CID 872082
N-[[4-(N-phenylanilino)phenyl]methylideneamino]benzenesulfonamide
CID 3660828
N-[(3-hydroxyphenyl)methylideneamino]benzenesulfonamide
CID 2692691
N-[(E)-benzylideneamino]-4-(2-oxopropylamino)benzenesulfonamide
CID 6900166
[(E)-benzylideneamino]urea
CID 6861419
N-[(E)-benzylideneamino]methanethioamide
CID 87476849
N-(benzylideneamino)-4-[4-[(benzylideneamino)carbamoyl]phenyl]sulfonylbenzamide
CID 4301325

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-benzylideneamino]sulfamoyl iodide?
The IUPAC name of N-[(Z)-benzylideneamino]sulfamoyl iodide (CID 129147769) is N-[(Z)-benzylideneamino]sulfamoyl iodide.
What is the SMILES notation for N-[(Z)-benzylideneamino]sulfamoyl iodide?
The canonical SMILES for N-[(Z)-benzylideneamino]sulfamoyl iodide is O=S(=O)(I)N/N=C\c1ccccc1.
What is the InChIKey of N-[(Z)-benzylideneamino]sulfamoyl iodide?
The InChIKey is IIGDOITZCFISTM-TWGQIWQCSA-N. The full InChI is InChI=1S/C7H7IN2O2S/c8-13(11,12)10-9-6-7-4-2-1-3-5-7/h1-6,10H/b9-6-.
What are the key properties of N-[(Z)-benzylideneamino]sulfamoyl iodide?
N-[(Z)-benzylideneamino]sulfamoyl iodide has a molecular weight of 310.12 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-benzylideneamino]sulfamoyl iodide is sourced from PubChem (CID 129147769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).