2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine

C17H20FNO2 — CID 107663995

IUPAC2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine
SMILESCCc1ccc(OC(CN)c2cccc(F)c2)c(OC)c1
InChIInChI=1S/C17H20FNO2/c1-3-12-7-8-15(16(9-12)20-2)21-17(11-19)13-5-4-6-14(18)10-13/h4-10,17H,3,11,19H2,1-2H3
InChIKeyZDDPHVOVDVMSDB-UHFFFAOYSA-N
MW289.35 g/mol
LogP3.48
Rot. Bonds6

About 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine

2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine (PubChem CID 107663995) has the molecular formula C17H20FNO2 and a molecular weight of 289.35 g/mol. Its IUPAC name is 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine
PubChem CID107663995
Molecular FormulaC17H20FNO2
Molecular Weight289.35 g/mol
Exact Mass289.15
IUPAC Name2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine
SMILESCCc1ccc(OC(CN)c2cccc(F)c2)c(OC)c1
InChIInChI=1S/C17H20FNO2/c1-3-12-7-8-15(16(9-12)20-2)21-17(11-19)13-5-4-6-14(18)10-13/h4-10,17H,3,11,19H2,1-2H3
InChIKeyZDDPHVOVDVMSDB-UHFFFAOYSA-N
XLogP3.48
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine 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

2-(4-ethyl-2-methoxyphenoxy)-2-(4-methylphenyl)ethanamine
CID 107664014
2-(2,4-difluorophenoxy)-2-(3-fluorophenyl)ethanamine
CID 55020254
[4-[2-amino-1-(3-chlorophenyl)ethoxy]-3-methoxyphenyl]methanol
CID 107742711
2-(4-bromo-2-propan-2-ylphenoxy)-2-(3-fluorophenyl)ethanamine
CID 115401662
2-(3-fluorophenyl)-3-[3-methoxy-4-(2-methylpropoxy)phenyl]propan-1-amine
CID 83975700
2-(2-methoxy-4-methylphenoxy)-2-phenylethanamine
CID 55017730
2-(3-ethylphenoxy)-2-(4-fluorophenyl)ethanamine
CID 55015460
2-(3-bromo-4-fluorophenoxy)-2-(3-fluorophenyl)ethanamine
CID 83232351
2-(2-bromo-4-fluorophenoxy)-2-(3-bromophenyl)ethanamine
CID 55017955
[4-(2-amino-1-thiophen-3-ylethoxy)-3-methoxyphenyl]methanol
CID 107742689
1-(3-aminophenyl)-2-(4-ethyl-2-methoxyphenoxy)ethanol
CID 107663977
2-(3-chloro-4-fluorophenoxy)-2-(3-fluorophenyl)ethanamine
CID 63879326

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine (CID 107663995) is 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine is CCc1ccc(OC(CN)c2cccc(F)c2)c(OC)c1.
What is the InChIKey of 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine?
The InChIKey is ZDDPHVOVDVMSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO2/c1-3-12-7-8-15(16(9-12)20-2)21-17(11-19)13-5-4-6-14(18)10-13/h4-10,17H,3,11,19H2,1-2H3.
What are the key properties of 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine?
2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine has a molecular weight of 289.35 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2-methoxyphenoxy)-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 107663995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).