2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine

C12H12F3N3 — CID 140866089

IUPAC2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCc1cc(C(F)(F)F)cn2nc(C3CC3)nc12
InChIInChI=1S/C12H12F3N3/c1-2-7-5-9(12(13,14)15)6-18-11(7)16-10(17-18)8-3-4-8/h5-6,8H,2-4H2,1H3
InChIKeyFCQSMOUWDHZLRH-UHFFFAOYSA-N
MW255.24 g/mol
LogP3.19
Rot. Bonds2

About 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine

2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 140866089) has the molecular formula C12H12F3N3 and a molecular weight of 255.24 g/mol. Its IUPAC name is 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID140866089
Molecular FormulaC12H12F3N3
Molecular Weight255.24 g/mol
Exact Mass255.10
IUPAC Name2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCCc1cc(C(F)(F)F)cn2nc(C3CC3)nc12
InChIInChI=1S/C12H12F3N3/c1-2-7-5-9(12(13,14)15)6-18-11(7)16-10(17-18)8-3-4-8/h5-6,8H,2-4H2,1H3
InChIKeyFCQSMOUWDHZLRH-UHFFFAOYSA-N
XLogP3.19
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.24
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 140866089) is 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine is CCc1cc(C(F)(F)F)cn2nc(C3CC3)nc12.
What is the InChIKey of 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is FCQSMOUWDHZLRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F3N3/c1-2-7-5-9(12(13,14)15)6-18-11(7)16-10(17-18)8-3-4-8/h5-6,8H,2-4H2,1H3.
What are the key properties of 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine?
2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 255.24 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-8-ethyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 140866089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).