5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine

Name: 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₉H₁₄F₃N — CID 168821693

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine

SMILESCc1cnc(-c2cccc(C(F)(F)F)c2)cc1-c1ccccc1

InChIInChI=1S/C19H14F3N/c1-13-12-23-18(11-17(13)14-6-3-2-4-7-14)15-8-5-9-16(10-15)19(20,21)22/h2-12H,1H3

InChIKeyITOJMVSGWCPQJW-UHFFFAOYSA-N

MW313.32 g/mol

LogP5.74

Rot. Bonds2

About 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine

5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine (PubChem CID 168821693) has the molecular formula C₁₉H₁₄F₃N and a molecular weight of 313.32 g/mol. Its IUPAC name is 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name	5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine
PubChem CID	168821693
Molecular Formula	C₁₉H₁₄F₃N
Molecular Weight	313.32 g/mol
Exact Mass	313.11
IUPAC Name	5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine
SMILES	Cc1cnc(-c2cccc(C(F)(F)F)c2)cc1-c1ccccc1
InChI	InChI=1S/C19H14F3N/c1-13-12-23-18(11-17(13)14-6-3-2-4-7-14)15-8-5-9-16(10-15)19(20,21)22/h2-12H,1H3
InChIKey	ITOJMVSGWCPQJW-UHFFFAOYSA-N
XLogP	5.74
TPSA	12.89 Å²
H-Bond Donors
H-Bond Acceptors	1
Rotatable Bonds	2
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	313.32
LogP ≤ 5	5.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine?

The IUPAC name of 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine (CID 168821693) is 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine.

What is the SMILES notation for 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine?

The canonical SMILES for 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine is Cc1cnc(-c2cccc(C(F)(F)F)c2)cc1-c1ccccc1.

What is the InChIKey of 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine?

The InChIKey is ITOJMVSGWCPQJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N/c1-13-12-23-18(11-17(13)14-6-3-2-4-7-14)15-8-5-9-16(10-15)19(20,21)22/h2-12H,1H3.

What are the key properties of 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine?

5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine has a molecular weight of 313.32 g/mol, XLogP of 5.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 5-methyl-4-phenyl-2-[3-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 168821693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 168821693 — identifiers, structure, computed properties (public domain)

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