6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole

C12H8F3N3 — CID 3076266

IUPAC6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole
SMILESFC(F)(F)c1cccc(-c2cc3nccn3[nH]2)c1
InChIInChI=1S/C12H8F3N3/c13-12(14,15)9-3-1-2-8(6-9)10-7-11-16-4-5-18(11)17-10/h1-7,17H
InChIKeyBJEGYQWOUHBPDF-UHFFFAOYSA-N
MW251.21 g/mol
LogP3.35
Rot. Bonds1

About 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole

6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole (PubChem CID 3076266) has the molecular formula C12H8F3N3 and a molecular weight of 251.21 g/mol. Its IUPAC name is 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole.

Molecular Properties

Compound Name6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole
PubChem CID3076266
Molecular FormulaC12H8F3N3
Molecular Weight251.21 g/mol
Exact Mass251.07
IUPAC Name6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole
SMILESFC(F)(F)c1cccc(-c2cc3nccn3[nH]2)c1
InChIInChI=1S/C12H8F3N3/c13-12(14,15)9-3-1-2-8(6-9)10-7-11-16-4-5-18(11)17-10/h1-7,17H
InChIKeyBJEGYQWOUHBPDF-UHFFFAOYSA-N
XLogP3.35
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.21
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole?
The IUPAC name of 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole (CID 3076266) is 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole.
What is the SMILES notation for 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole?
The canonical SMILES for 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole is FC(F)(F)c1cccc(-c2cc3nccn3[nH]2)c1.
What is the InChIKey of 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole?
The InChIKey is BJEGYQWOUHBPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F3N3/c13-12(14,15)9-3-1-2-8(6-9)10-7-11-16-4-5-18(11)17-10/h1-7,17H.
What are the key properties of 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole?
6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole has a molecular weight of 251.21 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(trifluoromethyl)phenyl]-5H-imidazo[1,2-b]pyrazole is sourced from PubChem (CID 3076266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).