6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine

C9H8F3N3O — CID 70835168

IUPAC6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine
SMILESCCc1ccc2nc(OC(F)(F)F)cn2n1
InChIInChI=1S/C9H8F3N3O/c1-2-6-3-4-7-13-8(5-15(7)14-6)16-9(10,11)12/h3-5H,2H2,1H3
InChIKeyNMPOBEYKFYHWFM-UHFFFAOYSA-N
MW231.18 g/mol
LogP2.19
Rot. Bonds2

About 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine

6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine (PubChem CID 70835168) has the molecular formula C9H8F3N3O and a molecular weight of 231.18 g/mol. Its IUPAC name is 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine
PubChem CID70835168
Molecular FormulaC9H8F3N3O
Molecular Weight231.18 g/mol
Exact Mass231.06
IUPAC Name6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine
SMILESCCc1ccc2nc(OC(F)(F)F)cn2n1
InChIInChI=1S/C9H8F3N3O/c1-2-6-3-4-7-13-8(5-15(7)14-6)16-9(10,11)12/h3-5H,2H2,1H3
InChIKeyNMPOBEYKFYHWFM-UHFFFAOYSA-N
XLogP2.19
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.18
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine?
The IUPAC name of 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine (CID 70835168) is 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine?
The canonical SMILES for 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine is CCc1ccc2nc(OC(F)(F)F)cn2n1.
What is the InChIKey of 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine?
The InChIKey is NMPOBEYKFYHWFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3O/c1-2-6-3-4-7-13-8(5-15(7)14-6)16-9(10,11)12/h3-5H,2H2,1H3.
What are the key properties of 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine?
6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine has a molecular weight of 231.18 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(trifluoromethoxy)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 70835168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).