1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine

C16H18FNO — CID 61077982

IUPAC1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine
SMILESCCOc1ccccc1C(N)Cc1cccc(F)c1
InChIInChI=1S/C16H18FNO/c1-2-19-16-9-4-3-8-14(16)15(18)11-12-6-5-7-13(17)10-12/h3-10,15H,2,11,18H2,1H3
InChIKeyHDAOIVIKHCJYTK-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.47
Rot. Bonds5

About 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine

1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine (PubChem CID 61077982) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine
PubChem CID61077982
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine
SMILESCCOc1ccccc1C(N)Cc1cccc(F)c1
InChIInChI=1S/C16H18FNO/c1-2-19-16-9-4-3-8-14(16)15(18)11-12-6-5-7-13(17)10-12/h3-10,15H,2,11,18H2,1H3
InChIKeyHDAOIVIKHCJYTK-UHFFFAOYSA-N
XLogP3.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-ethoxyphenyl)-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-(3-bromo-5-fluorophenyl)-1-(2-ethoxyphenyl)ethanamine
CID 115533554
(1R)-1-(2-ethoxyphenyl)-2-fluoroethanamine
CID 124705479
(1S)-1-(2-ethoxyphenyl)propan-1-amine;hydrochloride
CID 171221746
1-(2-bromo-4,5-dimethoxyphenyl)-2-(3-fluorophenyl)ethanamine
CID 43118220
(2,4-difluorophenyl)-(2-ethoxyphenyl)methanamine
CID 43197762
[(2-ethoxyphenyl)-(3-fluorophenyl)methyl]hydrazine
CID 105192906
2-(3-fluorophenyl)-1-phenylethanamine;hydrochloride
CID 25032833
2-(3-fluorophenyl)-1-(4-methylthiophen-3-yl)ethanamine
CID 79803199
1-(2-ethoxy-5-fluorophenyl)propan-2-amine
CID 55254144
2-(3-fluorophenyl)-1-pyridin-2-ylethanamine
CID 60819500
1-(2,5-dichlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43344680
1-(4-fluoro-2-methylphenyl)-2-phenylethanamine
CID 62790331

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine (CID 61077982) is 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine is CCOc1ccccc1C(N)Cc1cccc(F)c1.
What is the InChIKey of 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine?
The InChIKey is HDAOIVIKHCJYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-2-19-16-9-4-3-8-14(16)15(18)11-12-6-5-7-13(17)10-12/h3-10,15H,2,11,18H2,1H3.
What are the key properties of 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine?
1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine has a molecular weight of 259.32 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyphenyl)-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 61077982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).