1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine

C22H20N4 — CID 56644346

IUPAC1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine
SMILESNC1(c2ccc(-c3nn4ccnc4cc3-c3ccccc3)cc2)CCC1
InChIInChI=1S/C22H20N4/c23-22(11-4-12-22)18-9-7-17(8-10-18)21-19(16-5-2-1-3-6-16)15-20-24-13-14-26(20)25-21/h1-3,5-10,13-15H,4,11-12,23H2
InChIKeyGRIWUEMXZJIXMP-UHFFFAOYSA-N
MW340.43 g/mol
LogP4.40
Rot. Bonds3

About 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine

1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine (PubChem CID 56644346) has the molecular formula C22H20N4 and a molecular weight of 340.43 g/mol. Its IUPAC name is 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine.

Molecular Properties

Compound Name1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine
PubChem CID56644346
Molecular FormulaC22H20N4
Molecular Weight340.43 g/mol
Exact Mass340.17
IUPAC Name1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine
SMILESNC1(c2ccc(-c3nn4ccnc4cc3-c3ccccc3)cc2)CCC1
InChIInChI=1S/C22H20N4/c23-22(11-4-12-22)18-9-7-17(8-10-18)21-19(16-5-2-1-3-6-16)15-20-24-13-14-26(20)25-21/h1-3,5-10,13-15H,4,11-12,23H2
InChIKeyGRIWUEMXZJIXMP-UHFFFAOYSA-N
XLogP4.40
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine?
The IUPAC name of 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine (CID 56644346) is 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine.
What is the SMILES notation for 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine?
The canonical SMILES for 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine is NC1(c2ccc(-c3nn4ccnc4cc3-c3ccccc3)cc2)CCC1.
What is the InChIKey of 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine?
The InChIKey is GRIWUEMXZJIXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4/c23-22(11-4-12-22)18-9-7-17(8-10-18)21-19(16-5-2-1-3-6-16)15-20-24-13-14-26(20)25-21/h1-3,5-10,13-15H,4,11-12,23H2.
What are the key properties of 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine?
1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine has a molecular weight of 340.43 g/mol, XLogP of 4.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(7-phenylimidazo[1,2-b]pyridazin-6-yl)phenyl]cyclobutan-1-amine is sourced from PubChem (CID 56644346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).