1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine

C15H16FNO — CID 64855797

IUPAC1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine
SMILESCc1ccc(F)c(Oc2ccccc2C(C)N)c1
InChIInChI=1S/C15H16FNO/c1-10-7-8-13(16)15(9-10)18-14-6-4-3-5-12(14)11(2)17/h3-9,11H,17H2,1-2H3
InChIKeyRWWYPCAPCASENJ-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.95
Rot. Bonds3

About 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine

1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine (PubChem CID 64855797) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine
PubChem CID64855797
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine
SMILESCc1ccc(F)c(Oc2ccccc2C(C)N)c1
InChIInChI=1S/C15H16FNO/c1-10-7-8-13(16)15(9-10)18-14-6-4-3-5-12(14)11(2)17/h3-9,11H,17H2,1-2H3
InChIKeyRWWYPCAPCASENJ-UHFFFAOYSA-N
XLogP3.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-(2-fluoro-5-methylphenoxy)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

1-[2-(2,5-difluorophenoxy)phenyl]ethanamine
CID 55168326
(1R)-1-[2-(2-fluoro-5-methylphenoxy)phenyl]propan-1-amine
CID 103959407
1-[2-(2,3-difluorophenoxy)phenyl]ethanamine
CID 55143803
(1S)-1-[2-(3-fluoro-4-methylphenoxy)phenyl]ethanamine
CID 107169557
(1S)-1-[2-(2,5-dichlorophenoxy)phenyl]ethanamine
CID 28551604
(1S)-1-[2-(2-chloro-4-methylphenoxy)-5-fluorophenyl]ethanamine
CID 78938414
1-[3-(2-fluoro-5-methylphenoxy)phenyl]ethanamine
CID 79167584
1-[2-fluoro-6-(2-fluoro-5-methylphenoxy)phenyl]ethanol
CID 64854056
(1S)-1-[2-fluoro-6-(2-fluoro-5-methylphenoxy)phenyl]ethanol
CID 79001316
(1R)-1-(2-fluoro-5-methylphenyl)ethanamine
CID 45072341
(1S)-1-(2-fluoro-5-methylphenyl)ethanamine
CID 45072344
1-[2-(4-chlorophenoxy)phenyl]ethanamine
CID 43189173

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine?
The IUPAC name of 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine (CID 64855797) is 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine?
The canonical SMILES for 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine is Cc1ccc(F)c(Oc2ccccc2C(C)N)c1.
What is the InChIKey of 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine?
The InChIKey is RWWYPCAPCASENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-10-7-8-13(16)15(9-10)18-14-6-4-3-5-12(14)11(2)17/h3-9,11H,17H2,1-2H3.
What are the key properties of 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine?
1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine has a molecular weight of 245.30 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-fluoro-5-methylphenoxy)phenyl]ethanamine is sourced from PubChem (CID 64855797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).