2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine

C14H12F3NO — CID 142266365

IUPAC2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine
SMILESCc1cccc(-c2ccc(OCC(F)(F)F)cc2)n1
InChIInChI=1S/C14H12F3NO/c1-10-3-2-4-13(18-10)11-5-7-12(8-6-11)19-9-14(15,16)17/h2-8H,9H2,1H3
InChIKeyXBWWFKOCGFKZBC-UHFFFAOYSA-N
MW267.25 g/mol
LogP4.00
Rot. Bonds3

About 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine

2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine (PubChem CID 142266365) has the molecular formula C14H12F3NO and a molecular weight of 267.25 g/mol. Its IUPAC name is 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine
PubChem CID142266365
Molecular FormulaC14H12F3NO
Molecular Weight267.25 g/mol
Exact Mass267.09
IUPAC Name2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine
SMILESCc1cccc(-c2ccc(OCC(F)(F)F)cc2)n1
InChIInChI=1S/C14H12F3NO/c1-10-3-2-4-13(18-10)11-5-7-12(8-6-11)19-9-14(15,16)17/h2-8H,9H2,1H3
InChIKeyXBWWFKOCGFKZBC-UHFFFAOYSA-N
XLogP4.00
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.25
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-phenyl-6-(2,2,2-trifluoroethoxy)pyridine
CID 135043638
2-[[4-(6-methyl-2-pyridinyl)phenoxy]methyl]-1,3-benzothiazole
CID 139801734
acetylene;1,4-bis(2,2,2-trifluoroethoxy)benzene;ethane
CID 143388365
2-(4-isocyanophenyl)-6-methylpyridine
CID 58861254
ethane;methoxymethane;2-[3-(6-methyl-2-pyridinyl)-5-(trifluoromethyl)phenoxy]ethanol
CID 144950013
2-methyl-6-(6-phenyl-2-pyridinyl)pyridine
CID 14698682
4-methyl-2-[6-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]-2-pyridinyl]pyrimidine
CID 139724258
2-(3,4-difluorophenyl)-6-methylpyridine
CID 67475001
1-[4-[4-(2,2,2-trifluoroethoxy)phenyl]phenyl]ethanone
CID 176900313
1-bromo-2-[4-(2,2,2-trifluoroethoxy)phenyl]benzene
CID 166449861
N-(6-methyl-2-pyridinyl)-3-[[N'-methyl-N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]carbamimidoyl]amino]propanamide;hydroiodide
CID 111871256
2-methyl-6-[2-methyl-5-(trifluoromethoxy)phenyl]pyridine
CID 162575936

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine?
The IUPAC name of 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine (CID 142266365) is 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine.
What is the SMILES notation for 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine?
The canonical SMILES for 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine is Cc1cccc(-c2ccc(OCC(F)(F)F)cc2)n1.
What is the InChIKey of 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine?
The InChIKey is XBWWFKOCGFKZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3NO/c1-10-3-2-4-13(18-10)11-5-7-12(8-6-11)19-9-14(15,16)17/h2-8H,9H2,1H3.
What are the key properties of 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine?
2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine has a molecular weight of 267.25 g/mol, XLogP of 4.00, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[4-(2,2,2-trifluoroethoxy)phenyl]pyridine is sourced from PubChem (CID 142266365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).