7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

C11H6F3N5 — CID 66491471

IUPAC7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1nc2nccc(-c3ccccn3)n2n1
InChIInChI=1S/C11H6F3N5/c12-11(13,14)9-17-10-16-6-4-8(19(10)18-9)7-3-1-2-5-15-7/h1-6H
InChIKeyKJEFJVAIDLXCRP-UHFFFAOYSA-N
MW265.20 g/mol
LogP2.21
Rot. Bonds1

About 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 66491471) has the molecular formula C11H6F3N5 and a molecular weight of 265.20 g/mol. Its IUPAC name is 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID66491471
Molecular FormulaC11H6F3N5
Molecular Weight265.20 g/mol
Exact Mass265.06
IUPAC Name7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1nc2nccc(-c3ccccn3)n2n1
InChIInChI=1S/C11H6F3N5/c12-11(13,14)9-17-10-16-6-4-8(19(10)18-9)7-3-1-2-5-15-7/h1-6H
InChIKeyKJEFJVAIDLXCRP-UHFFFAOYSA-N
XLogP2.21
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.20
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine (CID 66491471) is 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine is FC(F)(F)c1nc2nccc(-c3ccccn3)n2n1.
What is the InChIKey of 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is KJEFJVAIDLXCRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6F3N5/c12-11(13,14)9-17-10-16-6-4-8(19(10)18-9)7-3-1-2-5-15-7/h1-6H.
What are the key properties of 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 265.20 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyridin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 66491471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).