3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

C17H10F3N5 — CID 10268868

IUPAC3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1ccn2c(-c3cccc(-c4ccccn4)n3)cnc2n1
InChIInChI=1S/C17H10F3N5/c18-17(19,20)15-7-9-25-14(10-22-16(25)24-15)13-6-3-5-12(23-13)11-4-1-2-8-21-11/h1-10H
InChIKeyXNAVDOMOELRZSM-UHFFFAOYSA-N
MW341.30 g/mol
LogP3.87
Rot. Bonds2

About 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine

3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (PubChem CID 10268868) has the molecular formula C17H10F3N5 and a molecular weight of 341.30 g/mol. Its IUPAC name is 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
PubChem CID10268868
Molecular FormulaC17H10F3N5
Molecular Weight341.30 g/mol
Exact Mass341.09
IUPAC Name3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
SMILESFC(F)(F)c1ccn2c(-c3cccc(-c4ccccn4)n3)cnc2n1
InChIInChI=1S/C17H10F3N5/c18-17(19,20)15-7-9-25-14(10-22-16(25)24-15)13-6-3-5-12(23-13)11-4-1-2-8-21-11/h1-10H
InChIKeyXNAVDOMOELRZSM-UHFFFAOYSA-N
XLogP3.87
TPSA55.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.30
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine (CID 10268868) is 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is FC(F)(F)c1ccn2c(-c3cccc(-c4ccccn4)n3)cnc2n1.
What is the InChIKey of 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
The InChIKey is XNAVDOMOELRZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F3N5/c18-17(19,20)15-7-9-25-14(10-22-16(25)24-15)13-6-3-5-12(23-13)11-4-1-2-8-21-11/h1-10H.
What are the key properties of 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine?
3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine has a molecular weight of 341.30 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-pyridin-2-yl-2-pyridinyl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 10268868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).