2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide

C17H18FNO2S — CID 110790579

IUPAC2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide
SMILESCSc1ccc(CCNC(=O)COc2ccc(F)cc2)cc1
InChIInChI=1S/C17H18FNO2S/c1-22-16-8-2-13(3-9-16)10-11-19-17(20)12-21-15-6-4-14(18)5-7-15/h2-9H,10-12H2,1H3,(H,19,20)
InChIKeySXWFCEBSPIBZCE-UHFFFAOYSA-N
MW319.40 g/mol
LogP3.29
Rot. Bonds7

About 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide

2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide (PubChem CID 110790579) has the molecular formula C17H18FNO2S and a molecular weight of 319.40 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide
PubChem CID110790579
Molecular FormulaC17H18FNO2S
Molecular Weight319.40 g/mol
Exact Mass319.10
IUPAC Name2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide
SMILESCSc1ccc(CCNC(=O)COc2ccc(F)cc2)cc1
InChIInChI=1S/C17H18FNO2S/c1-22-16-8-2-13(3-9-16)10-11-19-17(20)12-21-15-6-4-14(18)5-7-15/h2-9H,10-12H2,1H3,(H,19,20)
InChIKeySXWFCEBSPIBZCE-UHFFFAOYSA-N
XLogP3.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]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-hydroxyethyl)-2-(4-methylsulfanylphenoxy)acetamide
CID 63648820
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-methylsulfanylphenoxy)acetamide
CID 7893707
2-[4-[2-[3-(4-fluorophenyl)sulfanylpropanoylamino]ethyl]phenoxy]acetic acid
CID 119255389
[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
CID 7846555
butyl 4-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]benzoate
CID 7984412
2-(4-fluorophenoxy)-N-[2-[4-(propan-2-ylsulfamoyl)phenyl]ethyl]acetamide
CID 30126016
N-[2-(4-methylsulfanylphenyl)ethyl]propanamide
CID 110790560
3-(methylamino)-N-[2-(4-methylsulfanylphenyl)ethyl]propanamide
CID 115153341
N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide
CID 110487949
2-(4-fluorophenoxy)-N-[3-(methylamino)propyl]acetamide;hydrochloride
CID 119429392
1-(4-fluorophenyl)-2-(4-methylsulfanylphenoxy)ethanone
CID 60624163
2-(3-bromophenoxy)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 7935362

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide (CID 110790579) is 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide is CSc1ccc(CCNC(=O)COc2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide?
The InChIKey is SXWFCEBSPIBZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2S/c1-22-16-8-2-13(3-9-16)10-11-19-17(20)12-21-15-6-4-14(18)5-7-15/h2-9H,10-12H2,1H3,(H,19,20).
What are the key properties of 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide?
2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide has a molecular weight of 319.40 g/mol, XLogP of 3.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide is sourced from PubChem (CID 110790579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).