5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine

C19H14F3NO — CID 11209672

IUPAC5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine
SMILESCc1ccc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)nc1
InChIInChI=1S/C19H14F3NO/c1-13-9-10-17(23-12-13)15-6-4-5-14(11-15)16-7-2-3-8-18(16)24-19(20,21)22/h2-12H,1H3
InChIKeyTYQJCTAPPYHSHY-UHFFFAOYSA-N
MW329.32 g/mol
LogP5.62
Rot. Bonds3

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

5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine (PubChem CID 11209672) has the molecular formula C19H14F3NO and a molecular weight of 329.32 g/mol. Its IUPAC name is 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine.

Molecular Properties

Compound Name5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine
PubChem CID11209672
Molecular FormulaC19H14F3NO
Molecular Weight329.32 g/mol
Exact Mass329.10
IUPAC Name5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine
SMILESCc1ccc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)nc1
InChIInChI=1S/C19H14F3NO/c1-13-9-10-17(23-12-13)15-6-4-5-14(11-15)16-7-2-3-8-18(16)24-19(20,21)22/h2-12H,1H3
InChIKeyTYQJCTAPPYHSHY-UHFFFAOYSA-N
XLogP5.62
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.32
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3-[2-(trifluoromethoxy)phenyl]benzene
CID 69482191
5-methyl-2-[3-[3-(5-methyl-2-pyridinyl)phenyl]phenyl]pyridine
CID 171470506
2-[3-(2,3-difluorophenyl)phenyl]-5-methylpyridine
CID 59294841
5-methyl-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrimidine-2-carboxamide
CID 11291743
5-methyl-2-[3-(4-methylphenyl)phenyl]pyridine
CID 59294838
1-fluoro-3-[2-(trifluoromethoxy)phenyl]benzene
CID 46313769
N-methylsulfonyl-N-[4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrimidin-2-yl]methanesulfonamide
CID 11190977
methyl 6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxylate
CID 11394687
2-methyl-6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;4-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-4-carboxamide;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxamide;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxamide;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-4-carboxylic acid;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxylic acid;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxylic acid
CID 157159584
2-[3-(2-butylphenyl)phenyl]-5-methylpyridine
CID 140633735
N-[(2R)-1-amino-1-oxopropan-2-yl]-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyrimidine-2-carboxamide
CID 11270358
ethane;2-(3-fluorophenyl)-5-methylpyridine
CID 142255933

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine?
The IUPAC name of 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine (CID 11209672) is 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine.
What is the SMILES notation for 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine?
The canonical SMILES for 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine is Cc1ccc(-c2cccc(-c3ccccc3OC(F)(F)F)c2)nc1.
What is the InChIKey of 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine?
The InChIKey is TYQJCTAPPYHSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO/c1-13-9-10-17(23-12-13)15-6-4-5-14(11-15)16-7-2-3-8-18(16)24-19(20,21)22/h2-12H,1H3.
What are the key properties of 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine?
5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine has a molecular weight of 329.32 g/mol, XLogP of 5.62, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine is sourced from PubChem (CID 11209672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).