2,3-dimethoxy-5-(trifluoromethyl)pyridine

C8H8F3NO2 — CID 14837016

IUPAC2,3-dimethoxy-5-(trifluoromethyl)pyridine
SMILESCOc1cc(C(F)(F)F)cnc1OC
InChIInChI=1S/C8H8F3NO2/c1-13-6-3-5(8(9,10)11)4-12-7(6)14-2/h3-4H,1-2H3
InChIKeyYGZKUUOTWBKZIM-UHFFFAOYSA-N
MW207.15 g/mol
LogP2.12
Rot. Bonds2

About 2,3-dimethoxy-5-(trifluoromethyl)pyridine

2,3-dimethoxy-5-(trifluoromethyl)pyridine (PubChem CID 14837016) has the molecular formula C8H8F3NO2 and a molecular weight of 207.15 g/mol. Its IUPAC name is 2,3-dimethoxy-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2,3-dimethoxy-5-(trifluoromethyl)pyridine
PubChem CID14837016
Molecular FormulaC8H8F3NO2
Molecular Weight207.15 g/mol
Exact Mass207.05
IUPAC Name2,3-dimethoxy-5-(trifluoromethyl)pyridine
SMILESCOc1cc(C(F)(F)F)cnc1OC
InChIInChI=1S/C8H8F3NO2/c1-13-6-3-5(8(9,10)11)4-12-7(6)14-2/h3-4H,1-2H3
InChIKeyYGZKUUOTWBKZIM-UHFFFAOYSA-N
XLogP2.12
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.15
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-5-(trifluoromethyl)pyridine?
The IUPAC name of 2,3-dimethoxy-5-(trifluoromethyl)pyridine (CID 14837016) is 2,3-dimethoxy-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2,3-dimethoxy-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2,3-dimethoxy-5-(trifluoromethyl)pyridine is COc1cc(C(F)(F)F)cnc1OC.
What is the InChIKey of 2,3-dimethoxy-5-(trifluoromethyl)pyridine?
The InChIKey is YGZKUUOTWBKZIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3NO2/c1-13-6-3-5(8(9,10)11)4-12-7(6)14-2/h3-4H,1-2H3.
What are the key properties of 2,3-dimethoxy-5-(trifluoromethyl)pyridine?
2,3-dimethoxy-5-(trifluoromethyl)pyridine has a molecular weight of 207.15 g/mol, XLogP of 2.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 14837016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).