3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine

C17H11F3N2 — CID 46316443

IUPAC3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1cc(-c2cccnc2)cc(-c2cccnc2)c1
InChIInChI=1S/C17H11F3N2/c18-17(19,20)16-8-14(12-3-1-5-21-10-12)7-15(9-16)13-4-2-6-22-11-13/h1-11H
InChIKeyDGEMOMHTYWLALY-UHFFFAOYSA-N
MW300.28 g/mol
LogP4.83
Rot. Bonds2

About 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine

3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine (PubChem CID 46316443) has the molecular formula C17H11F3N2 and a molecular weight of 300.28 g/mol. Its IUPAC name is 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine
PubChem CID46316443
Molecular FormulaC17H11F3N2
Molecular Weight300.28 g/mol
Exact Mass300.09
IUPAC Name3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1cc(-c2cccnc2)cc(-c2cccnc2)c1
InChIInChI=1S/C17H11F3N2/c18-17(19,20)16-8-14(12-3-1-5-21-10-12)7-15(9-16)13-4-2-6-22-11-13/h1-11H
InChIKeyDGEMOMHTYWLALY-UHFFFAOYSA-N
XLogP4.83
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.28
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine (CID 46316443) is 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1cc(-c2cccnc2)cc(-c2cccnc2)c1.
What is the InChIKey of 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine?
The InChIKey is DGEMOMHTYWLALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11F3N2/c18-17(19,20)16-8-14(12-3-1-5-21-10-12)7-15(9-16)13-4-2-6-22-11-13/h1-11H.
What are the key properties of 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine?
3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine has a molecular weight of 300.28 g/mol, XLogP of 4.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-pyridin-3-yl-5-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 46316443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).