3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine

C12H13F3N4 — CID 134862876

IUPAC3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cnc2ncc(N3CCCCC3)n2c1
InChIInChI=1S/C12H13F3N4/c13-12(14,15)9-6-16-11-17-7-10(19(11)8-9)18-4-2-1-3-5-18/h6-8H,1-5H2
InChIKeyBNCOFGFECVOTEK-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.74
Rot. Bonds1

About 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine

3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 134862876) has the molecular formula C12H13F3N4 and a molecular weight of 270.26 g/mol. Its IUPAC name is 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID134862876
Molecular FormulaC12H13F3N4
Molecular Weight270.26 g/mol
Exact Mass270.11
IUPAC Name3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1cnc2ncc(N3CCCCC3)n2c1
InChIInChI=1S/C12H13F3N4/c13-12(14,15)9-6-16-11-17-7-10(19(11)8-9)18-4-2-1-3-5-18/h6-8H,1-5H2
InChIKeyBNCOFGFECVOTEK-UHFFFAOYSA-N
XLogP2.74
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Pyrimidine, 4-(1H-imidazol-1-yl)-2-(1-piperidinyl)-, monohydrochloride
CID 3071751
Pyrimidine, 2-(1H-imidazol-1-yl)-4-(1-piperidinyl)-, monohydrochloride
CID 3071759
N,N,2-trimethyl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidin-3-amine
CID 134862830
4-(1H-Imidazol-1-YL)-6-(piperidin-1-YL)pyrimidine
CID 10609459
3,6,8,10,12-Pentazatricyclo[7.4.0.02,6]trideca-1(13),2,4,7,9,11-hexaene
CID 91196695
N,5-dimethyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidin-4-amine
CID 164642198
2-Imidazol-1-yl-4-piperidin-1-ylpyrimidine
CID 3071760
Imidazo[1,2-A]pyrimidin-6-ylmethanamine
CID 55262624
6-(Trifluoromethyl)imidazo[1,2-A]pyrimidine
CID 55264025
2-Imidazol-1-yl-5-(trifluoromethyl)pyrimidine
CID 71227685
5-(1-Cyclopentylimidazol-2-yl)-2-(trifluoromethyl)pyrimidine
CID 89848956
5-(Trifluoromethyl)imidazo[1,2-c]pyrimidine
CID 117780280

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 134862876) is 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1cnc2ncc(N3CCCCC3)n2c1.
What is the InChIKey of 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is BNCOFGFECVOTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N4/c13-12(14,15)9-6-16-11-17-7-10(19(11)8-9)18-4-2-1-3-5-18/h6-8H,1-5H2.
What are the key properties of 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 270.26 g/mol, XLogP of 2.74, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-6-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 134862876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).