N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide

C16H16INO3 — CID 7671599

IUPACN-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide
SMILESCCOc1ccccc1NC(=O)COc1cccc(I)c1
InChIInChI=1S/C16H16INO3/c1-2-20-15-9-4-3-8-14(15)18-16(19)11-21-13-7-5-6-12(17)10-13/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyBWXSBFJJDIBVCY-UHFFFAOYSA-N
MW397.21 g/mol
LogP3.71
Rot. Bonds6

About N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide

N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide (PubChem CID 7671599) has the molecular formula C16H16INO3 and a molecular weight of 397.21 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide
PubChem CID7671599
Molecular FormulaC16H16INO3
Molecular Weight397.21 g/mol
Exact Mass397.02
IUPAC NameN-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide
SMILESCCOc1ccccc1NC(=O)COc1cccc(I)c1
InChIInChI=1S/C16H16INO3/c1-2-20-15-9-4-3-8-14(15)18-16(19)11-21-13-7-5-6-12(17)10-13/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyBWXSBFJJDIBVCY-UHFFFAOYSA-N
XLogP3.71
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.21
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 2591399
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 7919529
2-(4-bromo-3,5-dimethylphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 1329034
N-(2-ethoxyphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78768376
N-(2-ethoxyphenyl)-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide
CID 17341028
2-(2,6-dimethylphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 834898
N-(2-ethoxyphenyl)-2-(2-methoxyphenoxy)acetamide
CID 3891399
N-(2-ethoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 723516
N-(2-ethoxy-4-methylphenyl)-2-(3-methylphenoxy)acetamide
CID 87027069
N-ethyl-2-(3-iodophenoxy)acetamide
CID 35964603
2-(2,3-dichlorophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 7372395

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide (CID 7671599) is N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide is CCOc1ccccc1NC(=O)COc1cccc(I)c1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide?
The InChIKey is BWXSBFJJDIBVCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16INO3/c1-2-20-15-9-4-3-8-14(15)18-16(19)11-21-13-7-5-6-12(17)10-13/h3-10H,2,11H2,1H3,(H,18,19).
What are the key properties of N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide?
N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide has a molecular weight of 397.21 g/mol, XLogP of 3.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide is sourced from PubChem (CID 7671599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).