2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine

C19H14F3NO — CID 141119800

IUPAC2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(OCc2ccc(-c3ccccc3)cc2)nc1
InChIInChI=1S/C19H14F3NO/c20-19(21,22)17-10-11-18(23-12-17)24-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12H,13H2
InChIKeyUFDQLNXSPJRMFR-UHFFFAOYSA-N
MW329.32 g/mol
LogP5.35
Rot. Bonds4

About 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine

2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine (PubChem CID 141119800) has the molecular formula C19H14F3NO and a molecular weight of 329.32 g/mol. Its IUPAC name is 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine
PubChem CID141119800
Molecular FormulaC19H14F3NO
Molecular Weight329.32 g/mol
Exact Mass329.10
IUPAC Name2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(OCc2ccc(-c3ccccc3)cc2)nc1
InChIInChI=1S/C19H14F3NO/c20-19(21,22)17-10-11-18(23-12-17)24-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12H,13H2
InChIKeyUFDQLNXSPJRMFR-UHFFFAOYSA-N
XLogP5.35
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.32
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine (CID 141119800) is 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(OCc2ccc(-c3ccccc3)cc2)nc1.
What is the InChIKey of 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine?
The InChIKey is UFDQLNXSPJRMFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO/c20-19(21,22)17-10-11-18(23-12-17)24-13-14-6-8-16(9-7-14)15-4-2-1-3-5-15/h1-12H,13H2.
What are the key properties of 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine?
2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine has a molecular weight of 329.32 g/mol, XLogP of 5.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenylphenyl)methoxy]-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 141119800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).