2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine

C18H12F3NO — CID 71574031

IUPAC2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1cccc(-c2cccc(Oc3ccccc3)n2)c1
InChIInChI=1S/C18H12F3NO/c19-18(20,21)14-7-4-6-13(12-14)16-10-5-11-17(22-16)23-15-8-2-1-3-9-15/h1-12H
InChIKeyJMWMNEPBKIPOOG-UHFFFAOYSA-N
MW315.29 g/mol
LogP5.56
Rot. Bonds3

About 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine

2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine (PubChem CID 71574031) has the molecular formula C18H12F3NO and a molecular weight of 315.29 g/mol. Its IUPAC name is 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine
PubChem CID71574031
Molecular FormulaC18H12F3NO
Molecular Weight315.29 g/mol
Exact Mass315.09
IUPAC Name2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1cccc(-c2cccc(Oc3ccccc3)n2)c1
InChIInChI=1S/C18H12F3NO/c19-18(20,21)14-7-4-6-13(12-14)16-10-5-11-17(22-16)23-15-8-2-1-3-9-15/h1-12H
InChIKeyJMWMNEPBKIPOOG-UHFFFAOYSA-N
XLogP5.56
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500315.29
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methoxy-4,6-diphenylpyridine-3-carbonitrile
CID 678565
2-(4-Ethyl-2,6-dimethylphenoxy)-3,6-dimethyl-4-(pentan-3-yloxy)pyridine
CID 9927970
2-Methyl-6-(3-p-tolyloxy-prop-1-ynyl)pyridine
CID 11481793
4-(1-Ethyl-propenyloxy)-3,6-dimethyl-2-(2,4,6-trimethyl-phenoxy)-pyridine
CID 18392782
2-(2,6-Dimethylphenoxy)-3,6-dimethyl-4-(pentan-3-yloxy)pyridine
CID 21912293
2-(4-Fluoro-2,6-dimethylphenoxy)-3,6-dimethyl-4-(pentan-3-yloxy)pyridine
CID 21912361
2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol
CID 134158356
4-(4-Fluorophenyl)-2-methoxy-6-phenylpyridine-3-carbonitrile
CID 789665
4,6-Dimethyl-2-phenoxy-nicotinonitrile
CID 946983
2-(4-Methoxyphenyl)-4,6-diphenylpyridine
CID 1719430
2-(4-Fluorophenoxy)-4,6-dimethylpyridine-3-carbonitrile
CID 723818
9-Phenoxyacridine
CID 100640

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine (CID 71574031) is 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1cccc(-c2cccc(Oc3ccccc3)n2)c1.
What is the InChIKey of 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine?
The InChIKey is JMWMNEPBKIPOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3NO/c19-18(20,21)14-7-4-6-13(12-14)16-10-5-11-17(22-16)23-15-8-2-1-3-9-15/h1-12H.
What are the key properties of 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine?
2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine has a molecular weight of 315.29 g/mol, XLogP of 5.56, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-6-[3-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 71574031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).