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

C17H16N2O3 — CID 2591399

IUPAC2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)COc1cccc(C#N)c1
InChIInChI=1S/C17H16N2O3/c1-2-21-16-9-4-3-8-15(16)19-17(20)12-22-14-7-5-6-13(10-14)11-18/h3-10H,2,12H2,1H3,(H,19,20)
InChIKeyPBHRKEYEMDSIIK-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.97
Rot. Bonds6

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

2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide (PubChem CID 2591399) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide
PubChem CID2591399
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)COc1cccc(C#N)c1
InChIInChI=1S/C17H16N2O3/c1-2-21-16-9-4-3-8-15(16)19-17(20)12-22-14-7-5-6-13(10-14)11-18/h3-10H,2,12H2,1H3,(H,19,20)
InChIKeyPBHRKEYEMDSIIK-UHFFFAOYSA-N
XLogP2.97
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-ethoxyphenyl)-2-(3-iodophenoxy)acetamide
CID 7671599
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 7919529
N-(3-cyanophenyl)-2-(2-ethoxyanilino)acetamide
CID 9102058
2-(3-cyanophenoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 7964016
N-(2-bromo-4-methylphenyl)-2-(3-cyanophenoxy)acetamide
CID 2591410
N-(2-ethoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 723516
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
N-(2-ethoxyphenyl)-2-[4-(2-phenylpropan-2-yl)phenoxy]acetamide
CID 1183545
N-(2-cyanophenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955712

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide (CID 2591399) is 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)COc1cccc(C#N)c1.
What is the InChIKey of 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide?
The InChIKey is PBHRKEYEMDSIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-2-21-16-9-4-3-8-15(16)19-17(20)12-22-14-7-5-6-13(10-14)11-18/h3-10H,2,12H2,1H3,(H,19,20).
What are the key properties of 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide?
2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide has a molecular weight of 296.33 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyanophenoxy)-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 2591399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).