N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide

C11H13ClN4O — CID 90246038

IUPACN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cn2nc(Cl)ccc2n1
InChIInChI=1S/C11H13ClN4O/c1-11(2,3)10(17)14-8-6-16-9(13-8)5-4-7(12)15-16/h4-6H,1-3H3,(H,14,17)
InChIKeyVDHJZIUMQZDMCP-UHFFFAOYSA-N
MW252.71 g/mol
LogP2.37
Rot. Bonds1

About N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide

N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide (PubChem CID 90246038) has the molecular formula C11H13ClN4O and a molecular weight of 252.71 g/mol. Its IUPAC name is N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide
PubChem CID90246038
Molecular FormulaC11H13ClN4O
Molecular Weight252.71 g/mol
Exact Mass252.08
IUPAC NameN-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cn2nc(Cl)ccc2n1
InChIInChI=1S/C11H13ClN4O/c1-11(2,3)10(17)14-8-6-16-9(13-8)5-4-7(12)15-16/h4-6H,1-3H3,(H,14,17)
InChIKeyVDHJZIUMQZDMCP-UHFFFAOYSA-N
XLogP2.37
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.71
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide?
The IUPAC name of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide (CID 90246038) is N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cn2nc(Cl)ccc2n1.
What is the InChIKey of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide?
The InChIKey is VDHJZIUMQZDMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN4O/c1-11(2,3)10(17)14-8-6-16-9(13-8)5-4-7(12)15-16/h4-6H,1-3H3,(H,14,17).
What are the key properties of N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide?
N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide has a molecular weight of 252.71 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroimidazo[1,2-b]pyridazin-2-yl)-2,2-dimethylpropanamide is sourced from PubChem (CID 90246038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).