6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

C11H12F3N5 — CID 84809351

IUPAC6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1nc2ncc(C3CCCCN3)cn2n1
InChIInChI=1S/C11H12F3N5/c12-11(13,14)9-17-10-16-5-7(6-19(10)18-9)8-3-1-2-4-15-8/h5-6,8,15H,1-4H2
InChIKeyRQVIWWLWDUHKFI-UHFFFAOYSA-N
MW271.25 g/mol
LogP1.96
Rot. Bonds1

About 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine

6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 84809351) has the molecular formula C11H12F3N5 and a molecular weight of 271.25 g/mol. Its IUPAC name is 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID84809351
Molecular FormulaC11H12F3N5
Molecular Weight271.25 g/mol
Exact Mass271.10
IUPAC Name6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESFC(F)(F)c1nc2ncc(C3CCCCN3)cn2n1
InChIInChI=1S/C11H12F3N5/c12-11(13,14)9-17-10-16-5-7(6-19(10)18-9)8-3-1-2-4-15-8/h5-6,8,15H,1-4H2
InChIKeyRQVIWWLWDUHKFI-UHFFFAOYSA-N
XLogP1.96
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-ethyl-2-methyl-N-[1-(1-methyl-1H-pyrazol-4-yl)propyl]pyrimidin-4-amine
CID 50964673
3-((1,2,4)Triazolo(1,5-a)pyrimidin-6-yl)propan-1-amine dihydrochloride
CID 91623794
8-cyclopentyl-N-methyl-2-(trifluoromethyl)pyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 68940652
2-Piperazin-1-yl-3-(2,3,3-trifluoropropyl)pyrazolo[1,5-a]pyrimidine
CID 89810595
2-Piperazin-1-yl-3-(3,3,3-trifluoropropyl)pyrazolo[1,5-a]pyrimidine
CID 89810597
[4-[(3,3-Difluoropiperidin-4-yl)amino]pyrazolo[3,4-d]pyrimidin-1-yl] thiohypoiodite
CID 134219380
N-(fluoromethyl)-6-(3,5,5-trimethylhexyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 141267635
N-(trifluoromethyl)-6-(3,5,5-trimethylhexyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 142791630
2-(1-Methylpyrazol-4-yl)-2-[2-(trifluoromethyl)pyrimidin-5-yl]ethanamine
CID 142794012
N-(3,3-difluoropiperidin-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 145134224
N-[(1R,3S)-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)cyclohexyl]-5-(trifluoromethyl)pyrimidin-2-amine
CID 169848745
6-(2-Azaspiro[3.3]heptan-6-ylmethyl)-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 170784833

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine (CID 84809351) is 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine is FC(F)(F)c1nc2ncc(C3CCCCN3)cn2n1.
What is the InChIKey of 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is RQVIWWLWDUHKFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N5/c12-11(13,14)9-17-10-16-5-7(6-19(10)18-9)8-3-1-2-4-15-8/h5-6,8,15H,1-4H2.
What are the key properties of 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine?
6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 271.25 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-2-yl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 84809351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).