1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine

C15H14F3N — CID 54911995

IUPAC1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine
SMILESCC(N)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H14F3N/c1-10(19)13-4-2-3-5-14(13)11-6-8-12(9-7-11)15(16,17)18/h2-10H,19H2,1H3
InChIKeyFEUBYBZCQFKLLD-UHFFFAOYSA-N
MW265.28 g/mol
LogP4.39
Rot. Bonds2

About 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine

1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine (PubChem CID 54911995) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine
PubChem CID54911995
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine
SMILESCC(N)c1ccccc1-c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H14F3N/c1-10(19)13-4-2-3-5-14(13)11-6-8-12(9-7-11)15(16,17)18/h2-10H,19H2,1H3
InChIKeyFEUBYBZCQFKLLD-UHFFFAOYSA-N
XLogP4.39
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine?
The IUPAC name of 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine (CID 54911995) is 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine.
What is the SMILES notation for 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine?
The canonical SMILES for 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine is CC(N)c1ccccc1-c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine?
The InChIKey is FEUBYBZCQFKLLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c1-10(19)13-4-2-3-5-14(13)11-6-8-12(9-7-11)15(16,17)18/h2-10H,19H2,1H3.
What are the key properties of 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine?
1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine has a molecular weight of 265.28 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(trifluoromethyl)phenyl]phenyl]ethanamine is sourced from PubChem (CID 54911995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).