2,2,2-trifluoro-N-(2-phenylethyl)ethanimine

C10H10F3N — CID 68565292

IUPAC2,2,2-trifluoro-N-(2-phenylethyl)ethanimine
SMILESFC(F)(F)/C=N/CCc1ccccc1
InChIInChI=1S/C10H10F3N/c11-10(12,13)8-14-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2/b14-8+
InChIKeyFUWHZAJYLGQMMJ-RIYZIHGNSA-N
MW201.19 g/mol
LogP2.86
Rot. Bonds3

About 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine

2,2,2-trifluoro-N-(2-phenylethyl)ethanimine (PubChem CID 68565292) has the molecular formula C10H10F3N and a molecular weight of 201.19 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-phenylethyl)ethanimine
PubChem CID68565292
Molecular FormulaC10H10F3N
Molecular Weight201.19 g/mol
Exact Mass201.08
IUPAC Name2,2,2-trifluoro-N-(2-phenylethyl)ethanimine
SMILESFC(F)(F)/C=N/CCc1ccccc1
InChIInChI=1S/C10H10F3N/c11-10(12,13)8-14-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2/b14-8+
InChIKeyFUWHZAJYLGQMMJ-RIYZIHGNSA-N
XLogP2.86
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2,2,2-trifluoro-1-phenyl-N-(2-phenylethyl)ethanimine
CID 10912810
benzene;2-phenylethylbenzene
CID 18982764
N-(2-phenylethyl)-1-pyridin-2-ylmethanimine
CID 15790389
N-(2-phenylethyl)-1-(1H-pyrrol-2-yl)methanimine
CID 137097310
2,2,2-trifluoro-N-phenylethanimine
CID 86178154
3-hydroxy-5-phenyl-2-(2-phenylethyliminomethyl)cyclohex-2-en-1-one
CID 135433264
1-(2-phenylethyl)-4-(3,3,3-trifluoropropyl)benzene
CID 12783381
[(E)-4-bromo-7,7,7-trifluorohept-5-enyl]benzene
CID 90344339
hafnium;2-phenylethylbenzene
CID 173109801
4-[2-[(4-phenylphenyl)methylideneamino]ethyl]benzoic acid
CID 54335260
1,1,1,2,2-pentafluoro-5-phenylpentan-3-amine
CID 175153498
4,4,4-trifluorobut-2-enylbenzene
CID 12591112

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine?
The IUPAC name of 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine (CID 68565292) is 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine?
The canonical SMILES for 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine is FC(F)(F)/C=N/CCc1ccccc1.
What is the InChIKey of 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine?
The InChIKey is FUWHZAJYLGQMMJ-RIYZIHGNSA-N. The full InChI is InChI=1S/C10H10F3N/c11-10(12,13)8-14-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2/b14-8+.
What are the key properties of 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine?
2,2,2-trifluoro-N-(2-phenylethyl)ethanimine has a molecular weight of 201.19 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(2-phenylethyl)ethanimine is sourced from PubChem (CID 68565292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).