N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine

C15H15F2NO — CID 43314233

IUPACN-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine
SMILESCCNCc1cc(F)ccc1Oc1ccc(F)cc1
InChIInChI=1S/C15H15F2NO/c1-2-18-10-11-9-13(17)5-8-15(11)19-14-6-3-12(16)4-7-14/h3-9,18H,2,10H2,1H3
InChIKeyJPIJMYOTCCNUSA-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.87
Rot. Bonds5

About N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine

N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine (PubChem CID 43314233) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine
PubChem CID43314233
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC NameN-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine
SMILESCCNCc1cc(F)ccc1Oc1ccc(F)cc1
InChIInChI=1S/C15H15F2NO/c1-2-18-10-11-9-13(17)5-8-15(11)19-14-6-3-12(16)4-7-14/h3-9,18H,2,10H2,1H3
InChIKeyJPIJMYOTCCNUSA-UHFFFAOYSA-N
XLogP3.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]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

N-[[2-(4-bromophenoxy)-5-fluorophenyl]methyl]ethanamine
CID 43314185
N-[[2-(2,4-difluorophenoxy)-5-fluorophenyl]methyl]ethanamine
CID 43314106
N-[[5-fluoro-2-[(6-methyl-3-pyridinyl)oxy]phenyl]methyl]ethanamine
CID 62073087
N-[[2-(4-bromo-3-methylphenoxy)-5-fluorophenyl]methyl]ethanamine
CID 83141064
N-[[5-fluoro-2-(3-propan-2-ylphenoxy)phenyl]methyl]ethanamine
CID 43314145
3-[2-(ethylaminomethyl)-4-fluorophenoxy]-N,N-dimethylaniline
CID 61229881
N-[[5-fluoro-2-(2,4,5-trichlorophenoxy)phenyl]methyl]ethanamine
CID 43314088
N-[[4-(4-fluorophenoxy)-2-methylphenyl]methyl]ethanamine
CID 62130842
N-[[5-fluoro-2-(3-fluoro-4-methylphenoxy)phenyl]methyl]propan-1-amine
CID 107169870
N-[[3-(4-fluorophenoxy)-4-methylphenyl]methyl]ethanamine
CID 105406759
N-[[2-(3,5-dimethylphenoxy)-5-fluorophenyl]methyl]propan-1-amine
CID 43314214
N-[[2-(5-fluoro-2-methylphenoxy)phenyl]methyl]ethanamine
CID 102990039

Frequently Asked Questions

What is the IUPAC name of N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine?
The IUPAC name of N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine (CID 43314233) is N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine?
The canonical SMILES for N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine is CCNCc1cc(F)ccc1Oc1ccc(F)cc1.
What is the InChIKey of N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine?
The InChIKey is JPIJMYOTCCNUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-2-18-10-11-9-13(17)5-8-15(11)19-14-6-3-12(16)4-7-14/h3-9,18H,2,10H2,1H3.
What are the key properties of N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine?
N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine has a molecular weight of 263.29 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-fluoro-2-(4-fluorophenoxy)phenyl]methyl]ethanamine is sourced from PubChem (CID 43314233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).