4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol

C17H20FNO2 — CID 81301341

IUPAC4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol
SMILESCCNC(Cc1ccc(O)cc1)c1ccc(OC)cc1F
InChIInChI=1S/C17H20FNO2/c1-3-19-17(10-12-4-6-13(20)7-5-12)15-9-8-14(21-2)11-16(15)18/h4-9,11,17,19-20H,3,10H2,1-2H3
InChIKeyLJKPJGLDLIRUFB-UHFFFAOYSA-N
MW289.35 g/mol
LogP3.43
Rot. Bonds6

About 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol

4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol (PubChem CID 81301341) has the molecular formula C17H20FNO2 and a molecular weight of 289.35 g/mol. Its IUPAC name is 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol.

Molecular Properties

Compound Name4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol
PubChem CID81301341
Molecular FormulaC17H20FNO2
Molecular Weight289.35 g/mol
Exact Mass289.15
IUPAC Name4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol
SMILESCCNC(Cc1ccc(O)cc1)c1ccc(OC)cc1F
InChIInChI=1S/C17H20FNO2/c1-3-19-17(10-12-4-6-13(20)7-5-12)15-9-8-14(21-2)11-16(15)18/h4-9,11,17,19-20H,3,10H2,1-2H3
InChIKeyLJKPJGLDLIRUFB-UHFFFAOYSA-N
XLogP3.43
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol 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

1-(2,4-difluorophenyl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 43491085
1-(4-chloro-2-fluorophenyl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 61065176
N,3-diethyl-1-(2-fluoro-4-methoxyphenyl)pentan-1-amine
CID 82922285
1-(2-fluoro-4-methoxyphenyl)-2-(4-fluorophenyl)-N-methylethanamine
CID 43561357
N-ethyl-1-(2-fluoro-4-methoxyphenyl)-3-methoxybutan-1-amine
CID 103395819
N-ethyl-1-(2-fluoro-4-methoxyphenyl)but-3-yn-1-amine
CID 81304172
N-ethyl-1-(2-fluoro-4-methoxyphenyl)-2-pyridin-2-ylethanamine
CID 81304832
N-ethyl-1-(2-fluoro-4-methoxyphenyl)-2-(1,3-thiazol-2-yl)ethanamine
CID 81304833
1-(2-fluoro-4-methoxyphenyl)-2-(4-iodophenyl)-N-methylethanamine
CID 81305355
2-(3-bromothiophen-2-yl)-N-ethyl-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 81305467
1-(2-chloro-5-fluorophenyl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 105394780
N-ethyl-2-(1-ethylimidazol-2-yl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 81301344

Frequently Asked Questions

What is the IUPAC name of 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol?
The IUPAC name of 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol (CID 81301341) is 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol.
What is the SMILES notation for 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol?
The canonical SMILES for 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol is CCNC(Cc1ccc(O)cc1)c1ccc(OC)cc1F.
What is the InChIKey of 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol?
The InChIKey is LJKPJGLDLIRUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO2/c1-3-19-17(10-12-4-6-13(20)7-5-12)15-9-8-14(21-2)11-16(15)18/h4-9,11,17,19-20H,3,10H2,1-2H3.
What are the key properties of 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol?
4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol has a molecular weight of 289.35 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(ethylamino)-2-(2-fluoro-4-methoxyphenyl)ethyl]phenol is sourced from PubChem (CID 81301341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).