3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine

C7H2ClF6NO — CID 175669606

IUPAC3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)Oc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C7H2ClF6NO/c8-4-1-3(6(9,10)11)2-15-5(4)16-7(12,13)14/h1-2H
InChIKeyLTDGVXRRJAGBOQ-UHFFFAOYSA-N
MW265.54 g/mol
LogP3.65
Rot. Bonds1

About 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine

3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine (PubChem CID 175669606) has the molecular formula C7H2ClF6NO and a molecular weight of 265.54 g/mol. Its IUPAC name is 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine
PubChem CID175669606
Molecular FormulaC7H2ClF6NO
Molecular Weight265.54 g/mol
Exact Mass264.97
IUPAC Name3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)Oc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C7H2ClF6NO/c8-4-1-3(6(9,10)11)2-15-5(4)16-7(12,13)14/h1-2H
InChIKeyLTDGVXRRJAGBOQ-UHFFFAOYSA-N
XLogP3.65
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.54
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-2-methoxy-5-(trifluoromethyl)pyridine;molecular hydrogen
CID 161307255
3-chloro-2-ethoxy-5-(trifluoromethyl)pyridine
CID 71058681
3-chloro-2-(2-iodophenoxy)-5-(trifluoromethyl)pyridine
CID 63529961
2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]acetic acid
CID 56832322
2-(4-bromo-2,6-dichlorophenoxy)-3-chloro-5-(trifluoromethyl)pyridine
CID 169336505
2-bromo-3-chloro-5-(trifluoromethyl)pyridine
CID 2736237
(2R)-1-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-amine;hydrochloride
CID 142503813
3-chloro-2-[3-methyl-5-(trifluoromethoxy)phenyl]-5-(trifluoromethyl)pyridine
CID 142577160
3-chloro-2-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethenyl]-5-(trifluoromethyl)pyridine
CID 53396566
3-chloro-5-(trifluoromethyl)-2-[[3-(trifluoromethyl)phenoxy]methyl]pyridine
CID 2780427
3-chloro-2-(4-propan-2-yloxyphenoxy)-5-(trifluoromethyl)pyridine
CID 56627403
3-chloro-N,N-dimethyl-5-(trifluoromethyl)pyridin-2-amine
CID 14933767

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine?
The IUPAC name of 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine (CID 175669606) is 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine is FC(F)(F)Oc1ncc(C(F)(F)F)cc1Cl.
What is the InChIKey of 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine?
The InChIKey is LTDGVXRRJAGBOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2ClF6NO/c8-4-1-3(6(9,10)11)2-15-5(4)16-7(12,13)14/h1-2H.
What are the key properties of 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine?
3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine has a molecular weight of 265.54 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 175669606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).