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

C14H10F3N — CID 134843576

IUPAC2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine
SMILESFC(F)(F)/C=N/c1ccccc1-c1ccccc1
InChIInChI=1S/C14H10F3N/c15-14(16,17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-10H/b18-10+
InChIKeyCIIKNFQKXPQVTF-VCHYOVAHSA-N
MW249.24 g/mol
LogP4.62
Rot. Bonds2

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

2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine (PubChem CID 134843576) has the molecular formula C14H10F3N and a molecular weight of 249.24 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine
PubChem CID134843576
Molecular FormulaC14H10F3N
Molecular Weight249.24 g/mol
Exact Mass249.08
IUPAC Name2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine
SMILESFC(F)(F)/C=N/c1ccccc1-c1ccccc1
InChIInChI=1S/C14H10F3N/c15-14(16,17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-10H/b18-10+
InChIKeyCIIKNFQKXPQVTF-VCHYOVAHSA-N
XLogP4.62
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine?
The IUPAC name of 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine (CID 134843576) is 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine?
The canonical SMILES for 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine is FC(F)(F)/C=N/c1ccccc1-c1ccccc1.
What is the InChIKey of 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine?
The InChIKey is CIIKNFQKXPQVTF-VCHYOVAHSA-N. The full InChI is InChI=1S/C14H10F3N/c15-14(16,17)10-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-10H/b18-10+.
What are the key properties of 2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine?
2,2,2-trifluoro-N-(2-phenylphenyl)ethanimine has a molecular weight of 249.24 g/mol, XLogP of 4.62, 2 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-phenylphenyl)ethanimine is sourced from PubChem (CID 134843576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).