2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine

C16H17F2NO2 — CID 107700182

IUPAC2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine
SMILESCOc1ccc(COc2ccc(F)cc2CCN)c(F)c1
InChIInChI=1S/C16H17F2NO2/c1-20-14-4-2-12(15(18)9-14)10-21-16-5-3-13(17)8-11(16)6-7-19/h2-5,8-9H,6-7,10,19H2,1H3
InChIKeyVCLPXTXNPDLXFU-UHFFFAOYSA-N
MW293.31 g/mol
LogP3.05
Rot. Bonds6

About 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine

2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine (PubChem CID 107700182) has the molecular formula C16H17F2NO2 and a molecular weight of 293.31 g/mol. Its IUPAC name is 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine
PubChem CID107700182
Molecular FormulaC16H17F2NO2
Molecular Weight293.31 g/mol
Exact Mass293.12
IUPAC Name2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine
SMILESCOc1ccc(COc2ccc(F)cc2CCN)c(F)c1
InChIInChI=1S/C16H17F2NO2/c1-20-14-4-2-12(15(18)9-14)10-21-16-5-3-13(17)8-11(16)6-7-19/h2-5,8-9H,6-7,10,19H2,1H3
InChIKeyVCLPXTXNPDLXFU-UHFFFAOYSA-N
XLogP3.05
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.31
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]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-[2-[(2,5-difluorophenyl)methoxy]-5-fluorophenyl]ethanamine
CID 107700281
[3-[(2-fluoro-4-methoxyphenyl)methoxy]-4-methoxyphenyl]methanamine
CID 102876040
4-[[2-(2-aminoethyl)-4-fluorophenoxy]methyl]-3-fluorobenzonitrile
CID 107700296
2-[(2-fluoro-4-methoxyphenyl)methoxy]phenol
CID 102877217
1-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 102877123
(1S)-1-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanol
CID 102877125
[2-[(2-bromo-4-methoxyphenoxy)methyl]-4-fluorophenyl]methanamine
CID 104706865
2-fluoro-6-[(2-fluoro-4-methoxyphenyl)methoxy]naphthalene
CID 139853874
2-(4-fluoro-2-methoxyphenyl)ethanamine
CID 55254856
2-[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]ethanamine
CID 61482092
4-bromo-3-[(2-fluoro-4-methoxyphenyl)methoxy]aniline
CID 103009094
2-[5-methoxy-2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 60906080

Frequently Asked Questions

What is the IUPAC name of 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine?
The IUPAC name of 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine (CID 107700182) is 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine?
The canonical SMILES for 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine is COc1ccc(COc2ccc(F)cc2CCN)c(F)c1.
What is the InChIKey of 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine?
The InChIKey is VCLPXTXNPDLXFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F2NO2/c1-20-14-4-2-12(15(18)9-14)10-21-16-5-3-13(17)8-11(16)6-7-19/h2-5,8-9H,6-7,10,19H2,1H3.
What are the key properties of 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine?
2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine has a molecular weight of 293.31 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-fluoro-2-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 107700182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).