N-(2-iodophenyl)-3,5-dimethylbenzamide

C15H14INO — CID 2118558

IUPACN-(2-iodophenyl)-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccccc2I)c1
InChIInChI=1S/C15H14INO/c1-10-7-11(2)9-12(8-10)15(18)17-14-6-4-3-5-13(14)16/h3-9H,1-2H3,(H,17,18)
InChIKeyYQUFQURDYQMXOY-UHFFFAOYSA-N
MW351.19 g/mol
LogP4.16
Rot. Bonds2

About N-(2-iodophenyl)-3,5-dimethylbenzamide

N-(2-iodophenyl)-3,5-dimethylbenzamide (PubChem CID 2118558) has the molecular formula C15H14INO and a molecular weight of 351.19 g/mol. Its IUPAC name is N-(2-iodophenyl)-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-iodophenyl)-3,5-dimethylbenzamide
PubChem CID2118558
Molecular FormulaC15H14INO
Molecular Weight351.19 g/mol
Exact Mass351.01
IUPAC NameN-(2-iodophenyl)-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2ccccc2I)c1
InChIInChI=1S/C15H14INO/c1-10-7-11(2)9-12(8-10)15(18)17-14-6-4-3-5-13(14)16/h3-9H,1-2H3,(H,17,18)
InChIKeyYQUFQURDYQMXOY-UHFFFAOYSA-N
XLogP4.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.19
LogP ≤ 54.16
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-(3,5-dimethylphenyl)-3-(2-iodophenyl)urea
CID 108869034
2-[(3,5-dimethylbenzoyl)amino]benzoic acid
CID 16771715
N-(3-acetamido-2-methylphenyl)-3,5-dimethylbenzamide
CID 39975965
4-amino-N-(2-iodophenyl)-3-methylbenzamide
CID 28977721
3-hydroxy-N-(2-iodophenyl)-4-methylbenzamide
CID 28881825
N-[2-(chloromethyl)phenyl]-3,5-dimethylbenzamide
CID 114298542
N-(3-iodo-2-methylphenyl)-3-methylbenzamide
CID 113368760
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethylbenzamide
CID 43601336
4-[(2-iodophenyl)carbamoyl]benzoic acid
CID 43386509
3-hydroxy-N-(2-iodophenyl)benzamide
CID 28826262
3,4-dihydroxy-N-(2-iodophenyl)benzamide
CID 103956209
2-hydroxy-N-(2-iodophenyl)-4-methylbenzamide
CID 28881646

Frequently Asked Questions

What is the IUPAC name of N-(2-iodophenyl)-3,5-dimethylbenzamide?
The IUPAC name of N-(2-iodophenyl)-3,5-dimethylbenzamide (CID 2118558) is N-(2-iodophenyl)-3,5-dimethylbenzamide.
What is the SMILES notation for N-(2-iodophenyl)-3,5-dimethylbenzamide?
The canonical SMILES for N-(2-iodophenyl)-3,5-dimethylbenzamide is Cc1cc(C)cc(C(=O)Nc2ccccc2I)c1.
What is the InChIKey of N-(2-iodophenyl)-3,5-dimethylbenzamide?
The InChIKey is YQUFQURDYQMXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14INO/c1-10-7-11(2)9-12(8-10)15(18)17-14-6-4-3-5-13(14)16/h3-9H,1-2H3,(H,17,18).
What are the key properties of N-(2-iodophenyl)-3,5-dimethylbenzamide?
N-(2-iodophenyl)-3,5-dimethylbenzamide has a molecular weight of 351.19 g/mol, XLogP of 4.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-iodophenyl)-3,5-dimethylbenzamide is sourced from PubChem (CID 2118558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).