2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine

C13H8F3N3 — CID 164679284

IUPAC2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1c(-c2ccccc2)nc2ncccn12
InChIInChI=1S/C13H8F3N3/c14-13(15,16)11-10(9-5-2-1-3-6-9)18-12-17-7-4-8-19(11)12/h1-8H
InChIKeyHUDXCDJRHZNJOH-UHFFFAOYSA-N
MW263.22 g/mol
LogP3.42
Rot. Bonds1

About 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine

2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 164679284) has the molecular formula C13H8F3N3 and a molecular weight of 263.22 g/mol. Its IUPAC name is 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID164679284
Molecular FormulaC13H8F3N3
Molecular Weight263.22 g/mol
Exact Mass263.07
IUPAC Name2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1c(-c2ccccc2)nc2ncccn12
InChIInChI=1S/C13H8F3N3/c14-13(15,16)11-10(9-5-2-1-3-6-9)18-12-17-7-4-8-19(11)12/h1-8H
InChIKeyHUDXCDJRHZNJOH-UHFFFAOYSA-N
XLogP3.42
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 164679284) is 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1c(-c2ccccc2)nc2ncccn12.
What is the InChIKey of 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is HUDXCDJRHZNJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F3N3/c14-13(15,16)11-10(9-5-2-1-3-6-9)18-12-17-7-4-8-19(11)12/h1-8H.
What are the key properties of 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 263.22 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 164679284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).