2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine

C15H16FNO — CID 64854414

IUPAC2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
SMILESCc1ccc(F)c(OC(CN)c2ccccc2)c1
InChIInChI=1S/C15H16FNO/c1-11-7-8-13(16)14(9-11)18-15(10-17)12-5-3-2-4-6-12/h2-9,15H,10,17H2,1H3
InChIKeyRTOFLPIUPDQMOY-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.21
Rot. Bonds4

About 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine

2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine (PubChem CID 64854414) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine.

Molecular Properties

Compound Name2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
PubChem CID64854414
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
SMILESCc1ccc(F)c(OC(CN)c2ccccc2)c1
InChIInChI=1S/C15H16FNO/c1-11-7-8-13(16)14(9-11)18-15(10-17)12-5-3-2-4-6-12/h2-9,15H,10,17H2,1H3
InChIKeyRTOFLPIUPDQMOY-UHFFFAOYSA-N
XLogP3.21
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxy-4-methylphenoxy)-2-phenylethanamine
CID 55017730
2-(2-chloro-5-methylphenoxy)-2-phenylethanamine
CID 55017590
2-(3-chlorophenyl)-2-(2,5-dimethylphenoxy)ethanamine
CID 55019513
2-(2-chloro-5-methylphenoxy)-2-(3-methylphenyl)ethanamine
CID 55020668
2-(2-fluoro-3-methylphenoxy)-2-(3-methylphenyl)ethanamine
CID 107656247
2-(5-bromo-2-fluorophenoxy)-2-(4-fluorophenyl)ethanamine
CID 114671834
2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine
CID 55017685
2-(2-bromo-4-chlorophenoxy)-2-(3-methylphenyl)ethanamine
CID 55020468
2-(3-bromo-4-fluorophenoxy)-2-(3-methylphenyl)ethanamine
CID 83233344
2-(2-iodophenoxy)-2-phenylethanamine
CID 55017639
2-(5-bromo-2-fluorophenoxy)-2-pyridin-3-ylethanamine
CID 114671799
2-(4-chlorophenyl)-2-(3-methylphenoxy)ethanamine
CID 55015152

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine?
The IUPAC name of 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine (CID 64854414) is 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine.
What is the SMILES notation for 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine?
The canonical SMILES for 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine is Cc1ccc(F)c(OC(CN)c2ccccc2)c1.
What is the InChIKey of 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine?
The InChIKey is RTOFLPIUPDQMOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-11-7-8-13(16)14(9-11)18-15(10-17)12-5-3-2-4-6-12/h2-9,15H,10,17H2,1H3.
What are the key properties of 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine?
2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine has a molecular weight of 245.30 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine is sourced from PubChem (CID 64854414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).