4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide

C22H23ClN4O2 — CID 46847215

IUPAC4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide
SMILESCCN(C(=O)c1ccc(C(=O)c2cnc3ccc(Cl)nn23)cc1)C1CCCCC1
InChIInChI=1S/C22H23ClN4O2/c1-2-26(17-6-4-3-5-7-17)22(29)16-10-8-15(9-11-16)21(28)18-14-24-20-13-12-19(23)25-27(18)20/h8-14,17H,2-7H2,1H3
InChIKeyWURNROSIJDLPMN-UHFFFAOYSA-N
MW410.91 g/mol
LogP4.41
Rot. Bonds5

About 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide

4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide (PubChem CID 46847215) has the molecular formula C22H23ClN4O2 and a molecular weight of 410.91 g/mol. Its IUPAC name is 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide.

Molecular Properties

Compound Name4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide
PubChem CID46847215
Molecular FormulaC22H23ClN4O2
Molecular Weight410.91 g/mol
Exact Mass410.15
IUPAC Name4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide
SMILESCCN(C(=O)c1ccc(C(=O)c2cnc3ccc(Cl)nn23)cc1)C1CCCCC1
InChIInChI=1S/C22H23ClN4O2/c1-2-26(17-6-4-3-5-7-17)22(29)16-10-8-15(9-11-16)21(28)18-14-24-20-13-12-19(23)25-27(18)20/h8-14,17H,2-7H2,1H3
InChIKeyWURNROSIJDLPMN-UHFFFAOYSA-N
XLogP4.41
TPSA67.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.91
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide 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 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide?
The IUPAC name of 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide (CID 46847215) is 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide.
What is the SMILES notation for 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide?
The canonical SMILES for 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide is CCN(C(=O)c1ccc(C(=O)c2cnc3ccc(Cl)nn23)cc1)C1CCCCC1.
What is the InChIKey of 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide?
The InChIKey is WURNROSIJDLPMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClN4O2/c1-2-26(17-6-4-3-5-7-17)22(29)16-10-8-15(9-11-16)21(28)18-14-24-20-13-12-19(23)25-27(18)20/h8-14,17H,2-7H2,1H3.
What are the key properties of 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide?
4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide has a molecular weight of 410.91 g/mol, XLogP of 4.41, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloroimidazo[1,2-b]pyridazine-3-carbonyl)-N-cyclohexyl-N-ethylbenzamide is sourced from PubChem (CID 46847215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).