2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine

C17H20FNO — CID 61066475

IUPAC2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
SMILESCNC(Cc1cccc(F)c1)c1ccc(C)c(OC)c1
InChIInChI=1S/C17H20FNO/c1-12-7-8-14(11-17(12)20-3)16(19-2)10-13-5-4-6-15(18)9-13/h4-9,11,16,19H,10H2,1-3H3
InChIKeyCFBXXWPKYVSHJH-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.65
Rot. Bonds5

About 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine

2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine (PubChem CID 61066475) has the molecular formula C17H20FNO and a molecular weight of 273.35 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
PubChem CID61066475
Molecular FormulaC17H20FNO
Molecular Weight273.35 g/mol
Exact Mass273.15
IUPAC Name2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
SMILESCNC(Cc1cccc(F)c1)c1ccc(C)c(OC)c1
InChIInChI=1S/C17H20FNO/c1-12-7-8-14(11-17(12)20-3)16(19-2)10-13-5-4-6-15(18)9-13/h4-9,11,16,19H,10H2,1-3H3
InChIKeyCFBXXWPKYVSHJH-UHFFFAOYSA-N
XLogP3.65
TPSA21.26 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 ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine 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-fluorophenyl)-1-(4-methoxy-3-methylphenyl)-N-methylethanamine
CID 43487445
2-(3,5-difluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
CID 105412582
1-(3,4-dimethylphenyl)-2-(3-fluorophenyl)-N-methylethanamine
CID 43480184
1-(3-fluoro-4-methylphenyl)-2-(3-fluorophenyl)-N-methylethanamine
CID 60818353
2-(4-chloro-3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
CID 107891735
[1-(3,4-dimethoxyphenyl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105192122
2-(4-bromophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine
CID 61065671
2-(3-fluorophenyl)-1-(2-methoxy-5-methylphenyl)-N-methylethanamine
CID 43626286
[2-(3,5-difluorophenyl)-1-(3-methoxy-4-methylphenyl)ethyl]hydrazine
CID 105413049
N-ethyl-1-(3-methoxy-4-methylphenyl)-2-(3-methylphenyl)ethanamine
CID 62389756
2-(3,5-difluorophenyl)-1-(3-methoxyphenyl)-N-methylethanamine
CID 61496504
1-[3-(difluoromethoxy)phenyl]-2-(3-fluorophenyl)-N-methylethanamine
CID 61065406

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine?
The IUPAC name of 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine (CID 61066475) is 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine?
The canonical SMILES for 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine is CNC(Cc1cccc(F)c1)c1ccc(C)c(OC)c1.
What is the InChIKey of 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine?
The InChIKey is CFBXXWPKYVSHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO/c1-12-7-8-14(11-17(12)20-3)16(19-2)10-13-5-4-6-15(18)9-13/h4-9,11,16,19H,10H2,1-3H3.
What are the key properties of 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine?
2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine has a molecular weight of 273.35 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylethanamine is sourced from PubChem (CID 61066475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).