2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine

C17H20FNO — CID 116773330

IUPAC2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine
SMILESCCOC(c1ccccc1)C(N)c1cc(C)ccc1F
InChIInChI=1S/C17H20FNO/c1-3-20-17(13-7-5-4-6-8-13)16(19)14-11-12(2)9-10-15(14)18/h4-11,16-17H,3,19H2,1-2H3
InChIKeyZXINPHNGYXEPFI-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.91
Rot. Bonds5

About 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine

2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine (PubChem CID 116773330) has the molecular formula C17H20FNO and a molecular weight of 273.35 g/mol. Its IUPAC name is 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine.

Molecular Properties

Compound Name2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine
PubChem CID116773330
Molecular FormulaC17H20FNO
Molecular Weight273.35 g/mol
Exact Mass273.15
IUPAC Name2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine
SMILESCCOC(c1ccccc1)C(N)c1cc(C)ccc1F
InChIInChI=1S/C17H20FNO/c1-3-20-17(13-7-5-4-6-8-13)16(19)14-11-12(2)9-10-15(14)18/h4-11,16-17H,3,19H2,1-2H3
InChIKeyZXINPHNGYXEPFI-UHFFFAOYSA-N
XLogP3.91
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine 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-ethoxy-1-(2-fluorophenyl)-2-phenylethanamine
CID 116773494
1-(2,3-difluorophenyl)-2-ethoxy-2-phenylethanamine
CID 116773502
1-(2,6-difluoro-3-methylphenyl)-2-ethoxy-2-phenylethanamine
CID 116773344
2-ethoxy-1-(2-fluoro-4-methoxyphenyl)-2-phenylethanamine
CID 103395921
(1R)-1-(2-fluoro-5-methylphenyl)-2-methylbutan-1-amine;hydrochloride
CID 171204039
1-(3-bromo-2,6-difluorophenyl)-2-ethoxy-2-phenylethanamine
CID 106943100
1-(2,5-difluorophenyl)-2-methoxy-2-phenylethanamine
CID 116772931
1-(2,5-difluorophenyl)-2-ethoxy-2-phenylethanol
CID 116757204
1-(3,4-difluorophenyl)-2-ethoxy-2-phenylethanol
CID 116757203
[1-(3,4-difluorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
CID 105279283
2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine
CID 116772779
2-ethoxy-1-(3-fluoro-5-methylphenyl)-2-phenylethanol
CID 116757127

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine?
The IUPAC name of 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine (CID 116773330) is 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine.
What is the SMILES notation for 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine?
The canonical SMILES for 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine is CCOC(c1ccccc1)C(N)c1cc(C)ccc1F.
What is the InChIKey of 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine?
The InChIKey is ZXINPHNGYXEPFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO/c1-3-20-17(13-7-5-4-6-8-13)16(19)14-11-12(2)9-10-15(14)18/h4-11,16-17H,3,19H2,1-2H3.
What are the key properties of 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine?
2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine has a molecular weight of 273.35 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(2-fluoro-5-methylphenyl)-2-phenylethanamine is sourced from PubChem (CID 116773330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).