2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine

C11H12F3N3 — CID 123300285

IUPAC2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine
SMILESCCCCc1cn2ccnc(C(F)(F)F)c2n1
InChIInChI=1S/C11H12F3N3/c1-2-3-4-8-7-17-6-5-15-9(10(17)16-8)11(12,13)14/h5-7H,2-4H2,1H3
InChIKeyVOIFGSOZELKNBR-UHFFFAOYSA-N
MW243.23 g/mol
LogP3.09
Rot. Bonds3

About 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine

2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine (PubChem CID 123300285) has the molecular formula C11H12F3N3 and a molecular weight of 243.23 g/mol. Its IUPAC name is 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine
PubChem CID123300285
Molecular FormulaC11H12F3N3
Molecular Weight243.23 g/mol
Exact Mass243.10
IUPAC Name2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine
SMILESCCCCc1cn2ccnc(C(F)(F)F)c2n1
InChIInChI=1S/C11H12F3N3/c1-2-3-4-8-7-17-6-5-15-9(10(17)16-8)11(12,13)14/h5-7H,2-4H2,1H3
InChIKeyVOIFGSOZELKNBR-UHFFFAOYSA-N
XLogP3.09
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.23
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine?
The IUPAC name of 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine (CID 123300285) is 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine.
What is the SMILES notation for 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine?
The canonical SMILES for 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine is CCCCc1cn2ccnc(C(F)(F)F)c2n1.
What is the InChIKey of 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine?
The InChIKey is VOIFGSOZELKNBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N3/c1-2-3-4-8-7-17-6-5-15-9(10(17)16-8)11(12,13)14/h5-7H,2-4H2,1H3.
What are the key properties of 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine?
2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine has a molecular weight of 243.23 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-8-(trifluoromethyl)imidazo[1,2-a]pyrazine is sourced from PubChem (CID 123300285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).