N-(4-iodophenyl)-2-methoxyacetamide

C9H10INO2 — CID 836397

IUPACN-(4-iodophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(I)cc1
InChIInChI=1S/C9H10INO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyDSZMWGFCTKHVBA-UHFFFAOYSA-N
MW291.09 g/mol
LogP1.88
Rot. Bonds3

About N-(4-iodophenyl)-2-methoxyacetamide

N-(4-iodophenyl)-2-methoxyacetamide (PubChem CID 836397) has the molecular formula C9H10INO2 and a molecular weight of 291.09 g/mol. Its IUPAC name is N-(4-iodophenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-2-methoxyacetamide
PubChem CID836397
Molecular FormulaC9H10INO2
Molecular Weight291.09 g/mol
Exact Mass290.98
IUPAC NameN-(4-iodophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(I)cc1
InChIInChI=1S/C9H10INO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyDSZMWGFCTKHVBA-UHFFFAOYSA-N
XLogP1.88
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.09
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-iodophenyl)-2-methoxyacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-2-methoxyacetamide?
The IUPAC name of N-(4-iodophenyl)-2-methoxyacetamide (CID 836397) is N-(4-iodophenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(4-iodophenyl)-2-methoxyacetamide?
The canonical SMILES for N-(4-iodophenyl)-2-methoxyacetamide is COCC(=O)Nc1ccc(I)cc1.
What is the InChIKey of N-(4-iodophenyl)-2-methoxyacetamide?
The InChIKey is DSZMWGFCTKHVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10INO2/c1-13-6-9(12)11-8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of N-(4-iodophenyl)-2-methoxyacetamide?
N-(4-iodophenyl)-2-methoxyacetamide has a molecular weight of 291.09 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-2-methoxyacetamide is sourced from PubChem (CID 836397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).