N-(4-iodophenyl)-N-oxidohydroxylamine

C6H5INO2- — CID 58019943

IUPACN-(4-iodophenyl)-N-oxidohydroxylamine
SMILES[O-]N(O)c1ccc(I)cc1
InChIInChI=1S/C6H5INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4,9H/q-1
InChIKeySXVZCOHLTOSCLL-UHFFFAOYSA-N
MW250.02 g/mol
LogP1.98
Rot. Bonds1

About N-(4-iodophenyl)-N-oxidohydroxylamine

N-(4-iodophenyl)-N-oxidohydroxylamine (PubChem CID 58019943) has the molecular formula C6H5INO2- and a molecular weight of 250.02 g/mol. Its IUPAC name is N-(4-iodophenyl)-N-oxidohydroxylamine.

Molecular Properties

Compound NameN-(4-iodophenyl)-N-oxidohydroxylamine
PubChem CID58019943
Molecular FormulaC6H5INO2-
Molecular Weight250.02 g/mol
Exact Mass249.94
IUPAC NameN-(4-iodophenyl)-N-oxidohydroxylamine
SMILES[O-]N(O)c1ccc(I)cc1
InChIInChI=1S/C6H5INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4,9H/q-1
InChIKeySXVZCOHLTOSCLL-UHFFFAOYSA-N
XLogP1.98
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.02
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(dimethylamino)phenyl]-N-oxidohydroxylamine
CID 163142986
4-iodo-N-methyl-N-oxidoaniline
CID 163883000
4-iodo-N,N-bis(phosphanyl)aniline
CID 169286192
1,3-bis(4-iodophenyl)-1,3-dimethylurea
CID 101347516
tetrakis(N-oxido-N-phenylhydroxylamine) diphosphate
CID 20978317
4-iodo-N-[4-iodo-N-(trifluoromethyl)anilino]sulfanyl-N-(trifluoromethyl)aniline
CID 154170212
N'-(4-iodophenyl)-N,N'-dimethylacetohydrazide
CID 66998219
1,4-diiodobenzene;1,3,5-triiodobenzene
CID 19861513
4-(4-iodophenyl)-N-[4-(4-iodophenyl)phenyl]-N-phenylaniline
CID 139751422
N-[4-(4-iodophenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 131842725
N-hydroxy-N-(4-iodophenyl)acetamide;N-(4-iodophenyl)hydroxylamine;methane
CID 160519414
4-[(E)-2-(4-iodophenyl)ethenyl]-N,N-dimethylaniline
CID 10936986

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-N-oxidohydroxylamine?
The IUPAC name of N-(4-iodophenyl)-N-oxidohydroxylamine (CID 58019943) is N-(4-iodophenyl)-N-oxidohydroxylamine.
What is the SMILES notation for N-(4-iodophenyl)-N-oxidohydroxylamine?
The canonical SMILES for N-(4-iodophenyl)-N-oxidohydroxylamine is [O-]N(O)c1ccc(I)cc1.
What is the InChIKey of N-(4-iodophenyl)-N-oxidohydroxylamine?
The InChIKey is SXVZCOHLTOSCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4,9H/q-1.
What are the key properties of N-(4-iodophenyl)-N-oxidohydroxylamine?
N-(4-iodophenyl)-N-oxidohydroxylamine has a molecular weight of 250.02 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-N-oxidohydroxylamine is sourced from PubChem (CID 58019943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).