2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide

C22H20INO2 — CID 2501574

IUPAC2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide
SMILESCCOC(C(=O)Nc1ccc(I)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20INO2/c1-2-26-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(25)24-20-15-13-19(23)14-16-20/h3-16H,2H2,1H3,(H,24,25)
InChIKeyJSKSWIPRGLHKGD-UHFFFAOYSA-N
MW457.31 g/mol
LogP5.21
Rot. Bonds6

About 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide

2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide (PubChem CID 2501574) has the molecular formula C22H20INO2 and a molecular weight of 457.31 g/mol. Its IUPAC name is 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide
PubChem CID2501574
Molecular FormulaC22H20INO2
Molecular Weight457.31 g/mol
Exact Mass457.05
IUPAC Name2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide
SMILESCCOC(C(=O)Nc1ccc(I)cc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H20INO2/c1-2-26-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(25)24-20-15-13-19(23)14-16-20/h3-16H,2H2,1H3,(H,24,25)
InChIKeyJSKSWIPRGLHKGD-UHFFFAOYSA-N
XLogP5.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.31
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 3-(4-methoxyanilino)-3-oxo-2,2-diphenylpropanoate
CID 71516178
N'-(2-ethoxyphenyl)-N-(4-iodophenyl)oxamide
CID 108531107
(2R)-N-(4-iodophenyl)-2-phenoxybutanamide
CID 1369955
N-(4-iodophenyl)acetamide
CID 12147
ethyl 2-[4-(2,2-diphenylpropanoylamino)phenoxy]acetate
CID 100781586
2-anilino-N,2,2-triphenylacetamide
CID 2168373
N-(4-tert-butylphenyl)-N'-(4-iodophenyl)oxamide
CID 108529818
ethyl 2-methyl-2-(phenylcarbamoyl)butanoate
CID 142008434
N-(4-iodophenyl)-2-methoxy-2-phenylacetamide
CID 55024606
ethyl 3-[4-[(2-methyl-2-phenylpropanoyl)amino]phenyl]prop-2-enoate
CID 74542837
ethyl 2-benzyl-3-(4-chloroanilino)-3-oxo-2-phenylpropanoate
CID 71516313
1-N,2-N-bis(4-iodophenyl)benzene-1,2-dicarboxamide
CID 2852267

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide?
The IUPAC name of 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide (CID 2501574) is 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide.
What is the SMILES notation for 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide?
The canonical SMILES for 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide is CCOC(C(=O)Nc1ccc(I)cc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide?
The InChIKey is JSKSWIPRGLHKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20INO2/c1-2-26-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(25)24-20-15-13-19(23)14-16-20/h3-16H,2H2,1H3,(H,24,25).
What are the key properties of 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide?
2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide has a molecular weight of 457.31 g/mol, XLogP of 5.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(4-iodophenyl)-2,2-diphenylacetamide is sourced from PubChem (CID 2501574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).