3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide

C8H5F3N4O — CID 142598145

IUPAC3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide
SMILESNC(=O)c1nc2cccnn2c1C(F)(F)F
InChIInChI=1S/C8H5F3N4O/c9-8(10,11)6-5(7(12)16)14-4-2-1-3-13-15(4)6/h1-3H,(H2,12,16)
InChIKeyBCFNUEYPQFCBSV-UHFFFAOYSA-N
MW230.15 g/mol
LogP0.85
Rot. Bonds1

About 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide

3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide (PubChem CID 142598145) has the molecular formula C8H5F3N4O and a molecular weight of 230.15 g/mol. Its IUPAC name is 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide.

Molecular Properties

Compound Name3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide
PubChem CID142598145
Molecular FormulaC8H5F3N4O
Molecular Weight230.15 g/mol
Exact Mass230.04
IUPAC Name3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide
SMILESNC(=O)c1nc2cccnn2c1C(F)(F)F
InChIInChI=1S/C8H5F3N4O/c9-8(10,11)6-5(7(12)16)14-4-2-1-3-13-15(4)6/h1-3H,(H2,12,16)
InChIKeyBCFNUEYPQFCBSV-UHFFFAOYSA-N
XLogP0.85
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.15
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The IUPAC name of 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide (CID 142598145) is 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide.
What is the SMILES notation for 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The canonical SMILES for 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide is NC(=O)c1nc2cccnn2c1C(F)(F)F.
What is the InChIKey of 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide?
The InChIKey is BCFNUEYPQFCBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F3N4O/c9-8(10,11)6-5(7(12)16)14-4-2-1-3-13-15(4)6/h1-3H,(H2,12,16).
What are the key properties of 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide?
3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide has a molecular weight of 230.15 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethyl)imidazo[1,2-b]pyridazine-2-carboxamide is sourced from PubChem (CID 142598145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).