N-(4-bromophenyl)-2-iodoacetamide

C8H7BrINO — CID 28665

IUPACN-(4-bromophenyl)-2-iodoacetamide
SMILESO=C(CI)Nc1ccc(Br)cc1
InChIInChI=1S/C8H7BrINO/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5H2,(H,11,12)
InChIKeyKZEZEXWEHMUXPI-UHFFFAOYSA-N
MW339.96 g/mol
LogP2.82
Rot. Bonds2

About N-(4-bromophenyl)-2-iodoacetamide

N-(4-bromophenyl)-2-iodoacetamide (PubChem CID 28665) has the molecular formula C8H7BrINO and a molecular weight of 339.96 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-iodoacetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-iodoacetamide
PubChem CID28665
Molecular FormulaC8H7BrINO
Molecular Weight339.96 g/mol
Exact Mass338.88
IUPAC NameN-(4-bromophenyl)-2-iodoacetamide
SMILESO=C(CI)Nc1ccc(Br)cc1
InChIInChI=1S/C8H7BrINO/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5H2,(H,11,12)
InChIKeyKZEZEXWEHMUXPI-UHFFFAOYSA-N
XLogP2.82
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.96
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(4-Bromophenyl)urea
CID 16074
4'-Bromoacetanilide
CID 7683
N-(4-Iodophenyl)acetamide
CID 12147
N-(4-Bromophenyl)-2-chloroacetamide
CID 17374
2-Butenamide, N-(4-bromophenyl)-3-methyl-
CID 532095
N-(3-Bromophenyl)acetamide
CID 12123
Formamide, N-(4-bromophenyl)-
CID 17474
2-Bromo-N-phenylacetamide
CID 94818
2-Bromo-N-phenylpropionamide
CID 99113
N-(4-Bromophenyl)maleimide
CID 123301
n-(4-Bromophenyl)prop-2-enamide
CID 263609
3'-Bromopropionanilide
CID 806279

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-iodoacetamide?
The IUPAC name of N-(4-bromophenyl)-2-iodoacetamide (CID 28665) is N-(4-bromophenyl)-2-iodoacetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-iodoacetamide?
The canonical SMILES for N-(4-bromophenyl)-2-iodoacetamide is O=C(CI)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-iodoacetamide?
The InChIKey is KZEZEXWEHMUXPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrINO/c9-6-1-3-7(4-2-6)11-8(12)5-10/h1-4H,5H2,(H,11,12).
What are the key properties of N-(4-bromophenyl)-2-iodoacetamide?
N-(4-bromophenyl)-2-iodoacetamide has a molecular weight of 339.96 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-iodoacetamide is sourced from PubChem (CID 28665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).