2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine

C15H16FNO — CID 11565006

IUPAC2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine
SMILESNCCc1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C15H16FNO/c16-14-5-1-13(2-6-14)11-18-15-7-3-12(4-8-15)9-10-17/h1-8H,9-11,17H2
InChIKeyYMXMVTIEFGIJHO-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.91
Rot. Bonds5

About 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine

2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine (PubChem CID 11565006) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine
PubChem CID11565006
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine
SMILESNCCc1ccc(OCc2ccc(F)cc2)cc1
InChIInChI=1S/C15H16FNO/c16-14-5-1-13(2-6-14)11-18-15-7-3-12(4-8-15)9-10-17/h1-8H,9-11,17H2
InChIKeyYMXMVTIEFGIJHO-UHFFFAOYSA-N
XLogP2.91
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine?
The IUPAC name of 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine (CID 11565006) is 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine.
What is the SMILES notation for 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine?
The canonical SMILES for 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine is NCCc1ccc(OCc2ccc(F)cc2)cc1.
What is the InChIKey of 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine?
The InChIKey is YMXMVTIEFGIJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c16-14-5-1-13(2-6-14)11-18-15-7-3-12(4-8-15)9-10-17/h1-8H,9-11,17H2.
What are the key properties of 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine?
2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine has a molecular weight of 245.30 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-fluorophenyl)methoxy]phenyl]ethanamine is sourced from PubChem (CID 11565006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).