2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine

C16H18FNO — CID 62602782

IUPAC2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine
SMILESCOc1ccc(CC(N)c2ccccc2C)cc1F
InChIInChI=1S/C16H18FNO/c1-11-5-3-4-6-13(11)15(18)10-12-7-8-16(19-2)14(17)9-12/h3-9,15H,10,18H2,1-2H3
InChIKeyRIVBJKITFYXSFG-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.39
Rot. Bonds4

About 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine

2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine (PubChem CID 62602782) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine
PubChem CID62602782
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine
SMILESCOc1ccc(CC(N)c2ccccc2C)cc1F
InChIInChI=1S/C16H18FNO/c1-11-5-3-4-6-13(11)15(18)10-12-7-8-16(19-2)14(17)9-12/h3-9,15H,10,18H2,1-2H3
InChIKeyRIVBJKITFYXSFG-UHFFFAOYSA-N
XLogP3.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)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

1-(4-bromo-2-methylphenyl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829625
2-(3-fluoro-4-methoxyphenyl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105122098
1-(2,3-dichlorophenyl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829955
1-(2-bromo-4-fluorophenyl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829871
1-(4,5-dimethylthiophen-2-yl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829855
2-(3-fluoro-4-methoxyphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 115829866
2-(3,4-dimethoxyphenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 62790885
2-(3-fluoro-4-methoxyphenyl)-1-(5-methylfuran-2-yl)ethanamine
CID 115829621
1-(4-chloro-3-methylphenyl)-2-(3-fluoro-4-methoxyphenyl)ethanamine
CID 115829672
2-(3-fluoro-4-methoxyphenyl)-1-(3-methoxyphenyl)ethanamine
CID 62607710
2-(3,4-difluorophenyl)-1-(2-fluoro-3-methylphenyl)ethanamine
CID 81477102
1-(3-fluoro-4-methoxyphenyl)-3-(3-methylphenyl)propan-2-amine
CID 62604498

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine (CID 62602782) is 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine is COc1ccc(CC(N)c2ccccc2C)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine?
The InChIKey is RIVBJKITFYXSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-11-5-3-4-6-13(11)15(18)10-12-7-8-16(19-2)14(17)9-12/h3-9,15H,10,18H2,1-2H3.
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine?
2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine has a molecular weight of 259.32 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-1-(2-methylphenyl)ethanamine is sourced from PubChem (CID 62602782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).