2-(2,4,6-trifluorophenyl)ethanamine

C8H8F3N — CID 10631080

IUPAC2-(2,4,6-trifluorophenyl)ethanamine
SMILESNCCc1c(F)cc(F)cc1F
InChIInChI=1S/C8H8F3N/c9-5-3-7(10)6(1-2-12)8(11)4-5/h3-4H,1-2,12H2
InChIKeyODNMAXBOJVAYMM-UHFFFAOYSA-N
MW175.15 g/mol
LogP1.61
Rot. Bonds2

About 2-(2,4,6-trifluorophenyl)ethanamine

2-(2,4,6-trifluorophenyl)ethanamine (PubChem CID 10631080) has the molecular formula C8H8F3N and a molecular weight of 175.15 g/mol. Its IUPAC name is 2-(2,4,6-trifluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2,4,6-trifluorophenyl)ethanamine
PubChem CID10631080
Molecular FormulaC8H8F3N
Molecular Weight175.15 g/mol
Exact Mass175.06
IUPAC Name2-(2,4,6-trifluorophenyl)ethanamine
SMILESNCCc1c(F)cc(F)cc1F
InChIInChI=1S/C8H8F3N/c9-5-3-7(10)6(1-2-12)8(11)4-5/h3-4H,1-2,12H2
InChIKeyODNMAXBOJVAYMM-UHFFFAOYSA-N
XLogP1.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.15
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4,6-trifluorophenyl)ethanamine?
The IUPAC name of 2-(2,4,6-trifluorophenyl)ethanamine (CID 10631080) is 2-(2,4,6-trifluorophenyl)ethanamine.
What is the SMILES notation for 2-(2,4,6-trifluorophenyl)ethanamine?
The canonical SMILES for 2-(2,4,6-trifluorophenyl)ethanamine is NCCc1c(F)cc(F)cc1F.
What is the InChIKey of 2-(2,4,6-trifluorophenyl)ethanamine?
The InChIKey is ODNMAXBOJVAYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N/c9-5-3-7(10)6(1-2-12)8(11)4-5/h3-4H,1-2,12H2.
What are the key properties of 2-(2,4,6-trifluorophenyl)ethanamine?
2-(2,4,6-trifluorophenyl)ethanamine has a molecular weight of 175.15 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,6-trifluorophenyl)ethanamine is sourced from PubChem (CID 10631080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).