5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

C16H15F3N6 — CID 95829049

IUPAC5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCN(c3cnccn3)CC2)n2ccnc2n1
InChIInChI=1S/C16H15F3N6/c17-16(18,19)13-9-12(25-8-5-22-15(25)23-13)11-1-6-24(7-2-11)14-10-20-3-4-21-14/h3-5,8-11H,1-2,6-7H2
InChIKeyQVZLVVVCYCFSAA-UHFFFAOYSA-N
MW348.33 g/mol
LogP2.92
Rot. Bonds2

About 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 95829049) has the molecular formula C16H15F3N6 and a molecular weight of 348.33 g/mol. Its IUPAC name is 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID95829049
Molecular FormulaC16H15F3N6
Molecular Weight348.33 g/mol
Exact Mass348.13
IUPAC Name5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCN(c3cnccn3)CC2)n2ccnc2n1
InChIInChI=1S/C16H15F3N6/c17-16(18,19)13-9-12(25-8-5-22-15(25)23-13)11-1-6-24(7-2-11)14-10-20-3-4-21-14/h3-5,8-11H,1-2,6-7H2
InChIKeyQVZLVVVCYCFSAA-UHFFFAOYSA-N
XLogP2.92
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.33
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-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

Frequently Asked Questions

What is the IUPAC name of 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 95829049) is 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1cc(C2CCN(c3cnccn3)CC2)n2ccnc2n1.
What is the InChIKey of 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is QVZLVVVCYCFSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N6/c17-16(18,19)13-9-12(25-8-5-22-15(25)23-13)11-1-6-24(7-2-11)14-10-20-3-4-21-14/h3-5,8-11H,1-2,6-7H2.
What are the key properties of 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 348.33 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 95829049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).