N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide

C14H11BrINO2 — CID 62416238

IUPACN-(2-bromo-5-methoxyphenyl)-2-iodobenzamide
SMILESCOc1ccc(Br)c(NC(=O)c2ccccc2I)c1
InChIInChI=1S/C14H11BrINO2/c1-19-9-6-7-11(15)13(8-9)17-14(18)10-4-2-3-5-12(10)16/h2-8H,1H3,(H,17,18)
InChIKeyVFRVMIJXCWWKOG-UHFFFAOYSA-N
MW432.06 g/mol
LogP4.31
Rot. Bonds3

About N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide

N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide (PubChem CID 62416238) has the molecular formula C14H11BrINO2 and a molecular weight of 432.06 g/mol. Its IUPAC name is N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide.

Molecular Properties

Compound NameN-(2-bromo-5-methoxyphenyl)-2-iodobenzamide
PubChem CID62416238
Molecular FormulaC14H11BrINO2
Molecular Weight432.06 g/mol
Exact Mass430.90
IUPAC NameN-(2-bromo-5-methoxyphenyl)-2-iodobenzamide
SMILESCOc1ccc(Br)c(NC(=O)c2ccccc2I)c1
InChIInChI=1S/C14H11BrINO2/c1-19-9-6-7-11(15)13(8-9)17-14(18)10-4-2-3-5-12(10)16/h2-8H,1H3,(H,17,18)
InChIKeyVFRVMIJXCWWKOG-UHFFFAOYSA-N
XLogP4.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.06
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-N-(2-bromo-5-methoxyphenyl)-2-chlorobenzamide
CID 103989322
N-(2-bromo-5-methoxyphenyl)-4-methoxybenzamide
CID 62416430
N-(2-bromo-5-methoxyphenyl)-2-methoxy-5-methylbenzamide
CID 62415657
2-bromo-5-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218207
5-bromo-N-(2-bromo-5-methoxyphenyl)thiophene-3-carboxamide
CID 62415455
N-(2-bromo-5-methoxyphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 81245977
N-(2-iodophenyl)-2,4-dimethoxybenzamide
CID 3340182
2-amino-N-(2,5-dibromophenyl)-4-methoxybenzamide
CID 115412703
5-amino-N-(2-bromo-5-methoxyphenyl)-2-fluoro-3-methylbenzamide
CID 103296580
5-amino-N-(2-bromo-5-methoxyphenyl)-2,3-dichlorobenzamide
CID 107185397
N-(4-bromo-2,5-difluorophenyl)-2-iodobenzamide
CID 103842493
N-(4-acetamido-2,5-dimethoxyphenyl)-2-iodobenzamide
CID 4112051

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide?
The IUPAC name of N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide (CID 62416238) is N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide.
What is the SMILES notation for N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide?
The canonical SMILES for N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide is COc1ccc(Br)c(NC(=O)c2ccccc2I)c1.
What is the InChIKey of N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide?
The InChIKey is VFRVMIJXCWWKOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrINO2/c1-19-9-6-7-11(15)13(8-9)17-14(18)10-4-2-3-5-12(10)16/h2-8H,1H3,(H,17,18).
What are the key properties of N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide?
N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide has a molecular weight of 432.06 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-methoxyphenyl)-2-iodobenzamide is sourced from PubChem (CID 62416238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).