2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

C17H18FNO2 — CID 804157

IUPAC2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C17H18FNO2/c1-3-13-5-8-15(9-6-13)21-11-17(20)19-16-10-14(18)7-4-12(16)2/h4-10H,3,11H2,1-2H3,(H,19,20)
InChIKeySMULBEGACZBXPS-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.71
Rot. Bonds5

About 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (PubChem CID 804157) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
PubChem CID804157
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCCc1ccc(OCC(=O)Nc2cc(F)ccc2C)cc1
InChIInChI=1S/C17H18FNO2/c1-3-13-5-8-15(9-6-13)21-11-17(20)19-16-10-14(18)7-4-12(16)2/h4-10H,3,11H2,1-2H3,(H,19,20)
InChIKeySMULBEGACZBXPS-UHFFFAOYSA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (CID 804157) is 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is CCc1ccc(OCC(=O)Nc2cc(F)ccc2C)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The InChIKey is SMULBEGACZBXPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-3-13-5-8-15(9-6-13)21-11-17(20)19-16-10-14(18)7-4-12(16)2/h4-10H,3,11H2,1-2H3,(H,19,20).
What are the key properties of 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide has a molecular weight of 287.33 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 804157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).