N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine

C21H18N4 — CID 139514170

IUPACN-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine
SMILESCc1cn2nc(C)cc(N=C(c3ccccc3)c3ccccc3)c2n1
InChIInChI=1S/C21H18N4/c1-15-13-19(21-22-16(2)14-25(21)24-15)23-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14H,1-2H3
InChIKeyNJEYMAXUSZLMHI-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.52
Rot. Bonds3

About N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine

N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine (PubChem CID 139514170) has the molecular formula C21H18N4 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine
PubChem CID139514170
Molecular FormulaC21H18N4
Molecular Weight326.40 g/mol
Exact Mass326.15
IUPAC NameN-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine
SMILESCc1cn2nc(C)cc(N=C(c3ccccc3)c3ccccc3)c2n1
InChIInChI=1S/C21H18N4/c1-15-13-19(21-22-16(2)14-25(21)24-15)23-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14H,1-2H3
InChIKeyNJEYMAXUSZLMHI-UHFFFAOYSA-N
XLogP4.52
TPSA42.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine?
The IUPAC name of N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine (CID 139514170) is N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine.
What is the SMILES notation for N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine?
The canonical SMILES for N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine is Cc1cn2nc(C)cc(N=C(c3ccccc3)c3ccccc3)c2n1.
What is the InChIKey of N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine?
The InChIKey is NJEYMAXUSZLMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4/c1-15-13-19(21-22-16(2)14-25(21)24-15)23-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-14H,1-2H3.
What are the key properties of N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine?
N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine has a molecular weight of 326.40 g/mol, XLogP of 4.52, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylimidazo[1,2-b]pyridazin-8-yl)-1,1-diphenylmethanimine is sourced from PubChem (CID 139514170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).