2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine

C7H8F3N3O — CID 162560897

IUPAC2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
SMILESCc1nc(C)nc(OCC(F)(F)F)n1
InChIInChI=1S/C7H8F3N3O/c1-4-11-5(2)13-6(12-4)14-3-7(8,9)10/h3H2,1-2H3
InChIKeyGWGYCTVXWZIOJX-UHFFFAOYSA-N
MW207.15 g/mol
LogP1.43
Rot. Bonds2

About 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine

2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine (PubChem CID 162560897) has the molecular formula C7H8F3N3O and a molecular weight of 207.15 g/mol. Its IUPAC name is 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine.

Molecular Properties

Compound Name2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
PubChem CID162560897
Molecular FormulaC7H8F3N3O
Molecular Weight207.15 g/mol
Exact Mass207.06
IUPAC Name2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
SMILESCc1nc(C)nc(OCC(F)(F)F)n1
InChIInChI=1S/C7H8F3N3O/c1-4-11-5(2)13-6(12-4)14-3-7(8,9)10/h3H2,1-2H3
InChIKeyGWGYCTVXWZIOJX-UHFFFAOYSA-N
XLogP1.43
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.15
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The IUPAC name of 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine (CID 162560897) is 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine.
What is the SMILES notation for 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The canonical SMILES for 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine is Cc1nc(C)nc(OCC(F)(F)F)n1.
What is the InChIKey of 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
The InChIKey is GWGYCTVXWZIOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3O/c1-4-11-5(2)13-6(12-4)14-3-7(8,9)10/h3H2,1-2H3.
What are the key properties of 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine?
2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine has a molecular weight of 207.15 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine is sourced from PubChem (CID 162560897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).