2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide

C11H9BrIN3O2S — CID 55043820

IUPAC2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide
SMILESNc1ncc(Br)cc1S(=O)(=O)Nc1cccc(I)c1
InChIInChI=1S/C11H9BrIN3O2S/c12-7-4-10(11(14)15-6-7)19(17,18)16-9-3-1-2-8(13)5-9/h1-6,16H,(H2,14,15)
InChIKeyKIWGJHJTSPDOCY-UHFFFAOYSA-N
MW454.09 g/mol
LogP2.83
Rot. Bonds3

About 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide

2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide (PubChem CID 55043820) has the molecular formula C11H9BrIN3O2S and a molecular weight of 454.09 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide
PubChem CID55043820
Molecular FormulaC11H9BrIN3O2S
Molecular Weight454.09 g/mol
Exact Mass452.86
IUPAC Name2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide
SMILESNc1ncc(Br)cc1S(=O)(=O)Nc1cccc(I)c1
InChIInChI=1S/C11H9BrIN3O2S/c12-7-4-10(11(14)15-6-7)19(17,18)16-9-3-1-2-8(13)5-9/h1-6,16H,(H2,14,15)
InChIKeyKIWGJHJTSPDOCY-UHFFFAOYSA-N
XLogP2.83
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.09
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-bromo-N-(3-cyanophenyl)pyridine-3-sulfonamide
CID 62145031
N-(3-acetylphenyl)-2-amino-5-bromopyridine-3-sulfonamide
CID 22515885
2-amino-5-bromo-N-(3-iodophenyl)benzenesulfonamide
CID 54888660
2-amino-5-bromo-N-(3-ethoxyphenyl)pyridine-3-sulfonamide
CID 62156694
2-amino-5-bromo-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 22515848
2-amino-5-bromo-N-(2,3-dihydro-1H-inden-5-yl)pyridine-3-sulfonamide
CID 62150632
2-amino-5-bromo-N-(3,4,5-trifluorophenyl)pyridine-3-sulfonamide
CID 62813648
2,4-dibromo-N-(3-iodophenyl)benzenesulfonamide
CID 60823302
2-amino-5-bromo-N-pyridin-2-ylpyridine-3-sulfonamide
CID 55044230
4-bromo-2-chloro-N-(3-iodophenyl)benzenesulfonamide
CID 60640731
2-amino-5-bromo-N-(4-bromo-2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 62163149
2-amino-5-bromo-N-(2-methylsulfanylphenyl)pyridine-3-sulfonamide
CID 103766525

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide (CID 55043820) is 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide is Nc1ncc(Br)cc1S(=O)(=O)Nc1cccc(I)c1.
What is the InChIKey of 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide?
The InChIKey is KIWGJHJTSPDOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrIN3O2S/c12-7-4-10(11(14)15-6-7)19(17,18)16-9-3-1-2-8(13)5-9/h1-6,16H,(H2,14,15).
What are the key properties of 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide?
2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide has a molecular weight of 454.09 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(3-iodophenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 55043820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).