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

C12H13F3N4 — CID 46737155

IUPAC5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCNCC2)n2ccnc2n1
InChIInChI=1S/C12H13F3N4/c13-12(14,15)10-7-9(8-1-3-16-4-2-8)19-6-5-17-11(19)18-10/h5-8,16H,1-4H2
InChIKeyLDZZZLIFUFKGLP-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.22
Rot. Bonds1

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

5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 46737155) has the molecular formula C12H13F3N4 and a molecular weight of 270.26 g/mol. Its IUPAC name is 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID46737155
Molecular FormulaC12H13F3N4
Molecular Weight270.26 g/mol
Exact Mass270.11
IUPAC Name5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cc(C2CCNCC2)n2ccnc2n1
InChIInChI=1S/C12H13F3N4/c13-12(14,15)10-7-9(8-1-3-16-4-2-8)19-6-5-17-11(19)18-10/h5-8,16H,1-4H2
InChIKeyLDZZZLIFUFKGLP-UHFFFAOYSA-N
XLogP2.22
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-methyl-N-(4-(trifluoromethyl)phenyl)imidazo[1,2-a]pyrimidin-5-amine
CID 51347106
N-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-N-[3-(trifluoromethyl)phenyl]amine
CID 700205
N-[(1-ethyl-1H-imidazol-2-yl)methyl]-N,2-dimethyl-6-piperidin-3-ylpyrimidin-4-amine
CID 56704039
N-cyclopropyl-2-methyl-N-[(1-methylimidazol-2-yl)methyl]-6-piperidin-3-ylpyrimidin-4-amine
CID 56706955
4-cyclobutyl-6-methyl-2-{4-[(1-methyl-1H-imidazol-2-yl)methyl]piperazin-1-yl}pyrimidine
CID 56873336
4-cyclobutyl-N,6-dimethyl-N-(pyrazin-2-ylmethyl)pyrimidin-2-amine
CID 56881049
1-[4-[5-(Trifluoromethyl)imidazo[1,2-a]pyrimidin-7-yl]piperidin-1-yl]ethanone
CID 95826729
7-(1-Propan-2-ylpiperidin-4-yl)-5-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 95826739
1-[4-[7-(Trifluoromethyl)imidazo[1,2-a]pyrimidin-5-yl]piperidin-1-yl]ethanone
CID 95828270
5-(1-Pyrazin-2-ylpiperidin-4-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 95829049
2-[4-[5-(Trifluoromethyl)imidazo[1,2-a]pyrimidin-7-yl]piperidin-1-yl]acetamide
CID 110090226
5-(1-Propan-2-ylpiperidin-3-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 110258503

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 46737155) is 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1cc(C2CCNCC2)n2ccnc2n1.
What is the InChIKey of 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is LDZZZLIFUFKGLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N4/c13-12(14,15)10-7-9(8-1-3-16-4-2-8)19-6-5-17-11(19)18-10/h5-8,16H,1-4H2.
What are the key properties of 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 270.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-4-yl-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 46737155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).