2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide

C17H16N2O2 — CID 2100456

IUPAC2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)COc2ccc(C#N)cc2)c1
InChIInChI=1S/C17H16N2O2/c1-2-13-4-3-5-15(10-13)19-17(20)12-21-16-8-6-14(11-18)7-9-16/h3-10H,2,12H2,1H3,(H,19,20)
InChIKeyNDDZTFMXJJLJLB-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.14
Rot. Bonds5

About 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide

2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide (PubChem CID 2100456) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide
PubChem CID2100456
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)COc2ccc(C#N)cc2)c1
InChIInChI=1S/C17H16N2O2/c1-2-13-4-3-5-15(10-13)19-17(20)12-21-16-8-6-14(11-18)7-9-16/h3-10H,2,12H2,1H3,(H,19,20)
InChIKeyNDDZTFMXJJLJLB-UHFFFAOYSA-N
XLogP3.14
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-ethylphenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61028344
2-(4-acetamidophenoxy)-N-(3-ethylphenyl)acetamide
CID 7203355
N-(3-ethylphenyl)-2-(4-nitrophenoxy)acetamide
CID 2632103
3-[[2-(4-cyanophenoxy)acetyl]amino]-N-ethylbenzamide
CID 26171733
2-[4-(4-cyanophenyl)phenoxy]-N-(3-fluorophenyl)acetamide
CID 7966651
2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
CID 7935227
3-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]-N-ethylbenzamide
CID 9019837
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
N-(3-cyanophenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 798498
N-(4-cyanophenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61027849
N-(3-cyanophenyl)-2-(3,5-dimethoxyphenoxy)acetamide
CID 7713816
2-(3-ethylphenoxy)-N-(3-fluorophenyl)acetamide
CID 2709979

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide (CID 2100456) is 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide is CCc1cccc(NC(=O)COc2ccc(C#N)cc2)c1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide?
The InChIKey is NDDZTFMXJJLJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-2-13-4-3-5-15(10-13)19-17(20)12-21-16-8-6-14(11-18)7-9-16/h3-10H,2,12H2,1H3,(H,19,20).
What are the key properties of 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide?
2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide has a molecular weight of 280.33 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-(3-ethylphenyl)acetamide is sourced from PubChem (CID 2100456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).