2-iodo-N-(4-iodophenyl)benzamide

C13H9I2NO — CID 3118704

IUPAC2-iodo-N-(4-iodophenyl)benzamide
SMILESO=C(Nc1ccc(I)cc1)c1ccccc1I
InChIInChI=1S/C13H9I2NO/c14-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)15/h1-8H,(H,16,17)
InChIKeyQWNLPDFVMQBFHQ-UHFFFAOYSA-N
MW449.03 g/mol
LogP4.15
Rot. Bonds2

About 2-iodo-N-(4-iodophenyl)benzamide

2-iodo-N-(4-iodophenyl)benzamide (PubChem CID 3118704) has the molecular formula C13H9I2NO and a molecular weight of 449.03 g/mol. Its IUPAC name is 2-iodo-N-(4-iodophenyl)benzamide.

Molecular Properties

Compound Name2-iodo-N-(4-iodophenyl)benzamide
PubChem CID3118704
Molecular FormulaC13H9I2NO
Molecular Weight449.03 g/mol
Exact Mass448.88
IUPAC Name2-iodo-N-(4-iodophenyl)benzamide
SMILESO=C(Nc1ccc(I)cc1)c1ccccc1I
InChIInChI=1S/C13H9I2NO/c14-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)15/h1-8H,(H,16,17)
InChIKeyQWNLPDFVMQBFHQ-UHFFFAOYSA-N
XLogP4.15
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.03
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,2-N-bis(4-iodophenyl)benzene-1,2-dicarboxamide
CID 2852267
N-[4-(carbamoylamino)phenyl]-2-iodobenzamide
CID 33152104
N-(4-benzoylphenyl)-2-iodobenzamide
CID 1010139
2-iodo-N-(4-phenoxyphenyl)benzamide
CID 1010138
N-(4-anilinophenyl)-2-[(2-iodobenzoyl)amino]benzamide
CID 4941925
N-(4-iodophenyl)naphthalene-1-carboxamide
CID 1019200
N-[4-(difluoromethoxy)phenyl]-2-iodobenzamide
CID 7941252
N-(3-bromo-4-hydroxyphenyl)-2-iodobenzamide
CID 5090164
N-[4-(cyclopropylsulfonylamino)phenyl]-2-iodobenzamide
CID 175183969
2-iodo-N-[4-[(3-methylbenzoyl)amino]phenyl]benzamide
CID 1089815
2-iodo-N-(4-iodophenyl)-4-methylbenzamide
CID 100523539
2-iodo-N-(4-propoxyphenyl)benzamide
CID 4942969

Frequently Asked Questions

What is the IUPAC name of 2-iodo-N-(4-iodophenyl)benzamide?
The IUPAC name of 2-iodo-N-(4-iodophenyl)benzamide (CID 3118704) is 2-iodo-N-(4-iodophenyl)benzamide.
What is the SMILES notation for 2-iodo-N-(4-iodophenyl)benzamide?
The canonical SMILES for 2-iodo-N-(4-iodophenyl)benzamide is O=C(Nc1ccc(I)cc1)c1ccccc1I.
What is the InChIKey of 2-iodo-N-(4-iodophenyl)benzamide?
The InChIKey is QWNLPDFVMQBFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9I2NO/c14-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)15/h1-8H,(H,16,17).
What are the key properties of 2-iodo-N-(4-iodophenyl)benzamide?
2-iodo-N-(4-iodophenyl)benzamide has a molecular weight of 449.03 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-N-(4-iodophenyl)benzamide is sourced from PubChem (CID 3118704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).