5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

C16H15F3N6 — CID 110258966

IUPAC5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCCN(c3cnccn3)C2)n2ccnc2n1
InChIInChI=1S/C16H15F3N6/c17-16(18,19)13-8-12(25-7-5-22-15(25)23-13)11-2-1-6-24(10-11)14-9-20-3-4-21-14/h3-5,7-9,11H,1-2,6,10H2
InChIKeyWPGITHICSKYRKJ-UHFFFAOYSA-N
MW348.33 g/mol
LogP2.92
Rot. Bonds2

About 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 110258966) has the molecular formula C16H15F3N6 and a molecular weight of 348.33 g/mol. Its IUPAC name is 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID110258966
Molecular FormulaC16H15F3N6
Molecular Weight348.33 g/mol
Exact Mass348.13
IUPAC Name5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCCN(c3cnccn3)C2)n2ccnc2n1
InChIInChI=1S/C16H15F3N6/c17-16(18,19)13-8-12(25-7-5-22-15(25)23-13)11-2-1-6-24(10-11)14-9-20-3-4-21-14/h3-5,7-9,11H,1-2,6,10H2
InChIKeyWPGITHICSKYRKJ-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

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Related Compounds

T-808
CID 53339381
7-(Trifluoromethyl)-3-(6-(trifluoromethyl)pyridin-2-yl)imidazo[1,2-a]pyrimidine
CID 9945466
2-(4-Fluoro-phenyl)-3-pyridin-4-yl-imidazo[1,2-a]pyrimidin-7-ylamine
CID 9882951
3-(Pyridin-2-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 9921462
6-[4-[2-(3,4-difluorophenyl)ethyl]piperazin-1-yl]-N,N,8-trimethyl-3,5,8,12-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-13-amine
CID 11293909
6-[4-[2-(3,4-Difluorophenyl)ethyl]piperazin-1-yl]-8-methyl-3,5,8,12-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 11304370
4-(7-((dimethylamino)methyl)-2-(4-fluorophenyl)H-imidazo[1,2-a]pyridin-3-yl)-N,N-dimethylpyrimidin-2-amine
CID 44410501
(2-(4-fluorophenyl)-3-(pyrimidin-4-yl)H-imidazo[1,2-a]pyridin-7-yl)-N,N-dimethylmethanamine
CID 44410698
3-Cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)pyridin-3-yl]imidazo[1,2-a]pyridine
CID 71535399
US11312705, Example 17
CID 142426977
T-808 F-18
CID 66563709
7-Methyl-2-phenyl-5-[4-(2-pyridinyl)piperazino]imidazo[1,2-a]pyrimidine
CID 1472741

Frequently Asked Questions

What is the IUPAC name of 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 110258966) is 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1cc(C2CCCN(c3cnccn3)C2)n2ccnc2n1.
What is the InChIKey of 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is WPGITHICSKYRKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N6/c17-16(18,19)13-8-12(25-7-5-22-15(25)23-13)11-2-1-6-24(10-11)14-9-20-3-4-21-14/h3-5,7-9,11H,1-2,6,10H2.
What are the key properties of 5-(1-pyrazin-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
5-(1-pyrazin-2-ylpiperidin-3-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-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 110258966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).