2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine

C13H7F6NO — CID 118813597

IUPAC2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)Oc1ccccc1-c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C13H7F6NO/c14-12(15,16)8-5-6-10(20-7-8)9-3-1-2-4-11(9)21-13(17,18)19/h1-7H
InChIKeyFEVMAEOOONIGDS-UHFFFAOYSA-N
MW307.19 g/mol
LogP4.67
Rot. Bonds2

About 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine

2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine (PubChem CID 118813597) has the molecular formula C13H7F6NO and a molecular weight of 307.19 g/mol. Its IUPAC name is 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
PubChem CID118813597
Molecular FormulaC13H7F6NO
Molecular Weight307.19 g/mol
Exact Mass307.04
IUPAC Name2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)Oc1ccccc1-c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C13H7F6NO/c14-12(15,16)8-5-6-10(20-7-8)9-3-1-2-4-11(9)21-13(17,18)19/h1-7H
InChIKeyFEVMAEOOONIGDS-UHFFFAOYSA-N
XLogP4.67
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-iodo-2-[2-(trifluoromethoxy)phenyl]pyridine
CID 134630200
2-fluoro-3-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
CID 133089361
5-nitro-2-[2-(trifluoromethoxy)phenyl]pyridine
CID 71283944
3-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridin-2-amine
CID 119025158
1-(trifluoromethoxy)-2-[2-(trifluoromethoxy)phenyl]benzene
CID 18785200
2-methoxy-3-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
CID 134620611
6-[2-(trifluoromethoxy)phenyl]-2,3-bis(trifluoromethyl)pyridine
CID 134617611
2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine-3-carboxylic acid
CID 118819339
3-[2-(trifluoromethoxy)phenyl]-1,2,5-oxadiazole
CID 137332624
[2,5-bis[2-(trifluoromethoxy)phenyl]-4-pyridinyl]methanol
CID 134617951
2-(difluoromethoxy)-1-[2-(trifluoromethoxy)phenyl]-4-(trifluoromethyl)benzene
CID 134617209
iridium;tris(2-phenyl-5-(trifluoromethyl)pyridine)
CID 173119875

Frequently Asked Questions

What is the IUPAC name of 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine (CID 118813597) is 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine is FC(F)(F)Oc1ccccc1-c1ccc(C(F)(F)F)cn1.
What is the InChIKey of 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine?
The InChIKey is FEVMAEOOONIGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7F6NO/c14-12(15,16)8-5-6-10(20-7-8)9-3-1-2-4-11(9)21-13(17,18)19/h1-7H.
What are the key properties of 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine?
2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine has a molecular weight of 307.19 g/mol, XLogP of 4.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 118813597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).