6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine

C20H18FN5 — CID 170340773

IUPAC6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3cc(F)c4nc(C5CC=CC5)cn4c3)cc(C)c2n1
InChIInChI=1S/C20H18FN5/c1-12-7-17(24-26-9-13(2)22-19(12)26)15-8-16(21)20-23-18(11-25(20)10-15)14-5-3-4-6-14/h3-4,7-11,14H,5-6H2,1-2H3
InChIKeyLQHUXLFDPCXTJG-UHFFFAOYSA-N
MW347.40 g/mol
LogP4.23
Rot. Bonds2

About 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine

6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine (PubChem CID 170340773) has the molecular formula C20H18FN5 and a molecular weight of 347.40 g/mol. Its IUPAC name is 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
PubChem CID170340773
Molecular FormulaC20H18FN5
Molecular Weight347.40 g/mol
Exact Mass347.15
IUPAC Name6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3cc(F)c4nc(C5CC=CC5)cn4c3)cc(C)c2n1
InChIInChI=1S/C20H18FN5/c1-12-7-17(24-26-9-13(2)22-19(12)26)15-8-16(21)20-23-18(11-25(20)10-15)14-5-3-4-6-14/h3-4,7-11,14H,5-6H2,1-2H3
InChIKeyLQHUXLFDPCXTJG-UHFFFAOYSA-N
XLogP4.23
TPSA47.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine 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 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine (CID 170340773) is 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine is Cc1cn2nc(-c3cc(F)c4nc(C5CC=CC5)cn4c3)cc(C)c2n1.
What is the InChIKey of 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine?
The InChIKey is LQHUXLFDPCXTJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5/c1-12-7-17(24-26-9-13(2)22-19(12)26)15-8-16(21)20-23-18(11-25(20)10-15)14-5-3-4-6-14/h3-4,7-11,14H,5-6H2,1-2H3.
What are the key properties of 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine?
6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine has a molecular weight of 347.40 g/mol, XLogP of 4.23, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopent-3-en-1-yl-8-fluoroimidazo[1,2-a]pyridin-6-yl)-2,8-dimethylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 170340773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).