2-chloro-N-(2-iodophenyl)-4-methylbenzamide

C14H11ClINO — CID 106491010

IUPAC2-chloro-N-(2-iodophenyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2I)c(Cl)c1
InChIInChI=1S/C14H11ClINO/c1-9-6-7-10(11(15)8-9)14(18)17-13-5-3-2-4-12(13)16/h2-8H,1H3,(H,17,18)
InChIKeyFSUHIYRNMNQNKP-UHFFFAOYSA-N
MW371.61 g/mol
LogP4.51
Rot. Bonds2

About 2-chloro-N-(2-iodophenyl)-4-methylbenzamide

2-chloro-N-(2-iodophenyl)-4-methylbenzamide (PubChem CID 106491010) has the molecular formula C14H11ClINO and a molecular weight of 371.61 g/mol. Its IUPAC name is 2-chloro-N-(2-iodophenyl)-4-methylbenzamide.

Molecular Properties

Compound Name2-chloro-N-(2-iodophenyl)-4-methylbenzamide
PubChem CID106491010
Molecular FormulaC14H11ClINO
Molecular Weight371.61 g/mol
Exact Mass370.96
IUPAC Name2-chloro-N-(2-iodophenyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2I)c(Cl)c1
InChIInChI=1S/C14H11ClINO/c1-9-6-7-10(11(15)8-9)14(18)17-13-5-3-2-4-12(13)16/h2-8H,1H3,(H,17,18)
InChIKeyFSUHIYRNMNQNKP-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.61
LogP ≤ 54.51
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

2-hydroxy-N-(2-iodophenyl)-4-methylbenzamide
CID 28881646
N-(2-chloro-4-methylphenyl)-2-iodobenzamide
CID 8886012
2-hydrazinyl-N-(2-iodophenyl)-5-methylbenzamide
CID 62512985
N-(2-bromo-3-methylphenyl)-2-chloro-4-methylbenzamide
CID 106509671
N-(2-iodophenyl)-2-methoxy-5-methylbenzamide
CID 34049921
4-bromo-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 47299820
4-amino-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967456
2-(ethylamino)-N-(2-iodophenyl)-5-methylbenzamide
CID 62508809
N-[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]-2-chloro-4-methylbenzamide
CID 100520474
N-(2-chloro-4-methylphenyl)-2-methylbenzamide
CID 2540447
N-(2-chlorophenyl)-2,5-dimethylbenzamide
CID 925340
N-(5-amino-2-methylphenyl)-2-chloro-4-methylbenzamide
CID 106860345

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-iodophenyl)-4-methylbenzamide?
The IUPAC name of 2-chloro-N-(2-iodophenyl)-4-methylbenzamide (CID 106491010) is 2-chloro-N-(2-iodophenyl)-4-methylbenzamide.
What is the SMILES notation for 2-chloro-N-(2-iodophenyl)-4-methylbenzamide?
The canonical SMILES for 2-chloro-N-(2-iodophenyl)-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccccc2I)c(Cl)c1.
What is the InChIKey of 2-chloro-N-(2-iodophenyl)-4-methylbenzamide?
The InChIKey is FSUHIYRNMNQNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClINO/c1-9-6-7-10(11(15)8-9)14(18)17-13-5-3-2-4-12(13)16/h2-8H,1H3,(H,17,18).
What are the key properties of 2-chloro-N-(2-iodophenyl)-4-methylbenzamide?
2-chloro-N-(2-iodophenyl)-4-methylbenzamide has a molecular weight of 371.61 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-iodophenyl)-4-methylbenzamide is sourced from PubChem (CID 106491010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).