2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine

C19H14F3N — CID 135062376

IUPAC2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine
SMILESCc1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)cc1
InChIInChI=1S/C19H14F3N/c1-13-5-7-14(8-6-13)16-10-9-15(19(20,21)22)12-17(16)18-4-2-3-11-23-18/h2-12H,1H3
InChIKeySBLXJQBSDHCBSJ-UHFFFAOYSA-N
MW313.32 g/mol
LogP5.74
Rot. Bonds2

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

2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine (PubChem CID 135062376) has the molecular formula C19H14F3N and a molecular weight of 313.32 g/mol. Its IUPAC name is 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine
PubChem CID135062376
Molecular FormulaC19H14F3N
Molecular Weight313.32 g/mol
Exact Mass313.11
IUPAC Name2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine
SMILESCc1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)cc1
InChIInChI=1S/C19H14F3N/c1-13-5-7-14(8-6-13)16-10-9-15(19(20,21)22)12-17(16)18-4-2-3-11-23-18/h2-12H,1H3
InChIKeySBLXJQBSDHCBSJ-UHFFFAOYSA-N
XLogP5.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.32
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Triprolidine
CID 5282443
(+-)-Dimethindene
CID 21855
Pheniramine
CID 4761
Azatadine
CID 19861
Triprolidine Hydrochloride Anhydrous
CID 5702129
2-(3-Phenylpropyl)Pyridine
CID 459494
3-Phenylpyridine
CID 13886
2,3-Diphenylpyrazine
CID 243907
2-Phenylpyridine
CID 13887
2-(Phenylmethyl)pyridine
CID 7581
3-Benzhydrylpyridine
CID 77251
Phenanthridine
CID 9189

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine (CID 135062376) is 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine is Cc1ccc(-c2ccc(C(F)(F)F)cc2-c2ccccn2)cc1.
What is the InChIKey of 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine?
The InChIKey is SBLXJQBSDHCBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N/c1-13-5-7-14(8-6-13)16-10-9-15(19(20,21)22)12-17(16)18-4-2-3-11-23-18/h2-12H,1H3.
What are the key properties of 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine?
2-[2-(4-methylphenyl)-5-(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 2-[2-(4-methylphenyl)-5-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 135062376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).