6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine

C24H27FN6 — CID 170593629

IUPAC6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3cc(F)c4nc(C5CCN(CC6CC6)CC5)cn4c3)cc(C)c2n1
InChIInChI=1S/C24H27FN6/c1-15-9-21(28-31-11-16(2)26-23(15)31)19-10-20(25)24-27-22(14-30(24)13-19)18-5-7-29(8-6-18)12-17-3-4-17/h9-11,13-14,17-18H,3-8,12H2,1-2H3
InChIKeyMVKCJDVDYUPEJI-UHFFFAOYSA-N
MW418.52 g/mol
LogP4.39
Rot. Bonds4

About 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine

6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine (PubChem CID 170593629) has the molecular formula C24H27FN6 and a molecular weight of 418.52 g/mol. Its IUPAC name is 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
PubChem CID170593629
Molecular FormulaC24H27FN6
Molecular Weight418.52 g/mol
Exact Mass418.23
IUPAC Name6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine
SMILESCc1cn2nc(-c3cc(F)c4nc(C5CCN(CC6CC6)CC5)cn4c3)cc(C)c2n1
InChIInChI=1S/C24H27FN6/c1-15-9-21(28-31-11-16(2)26-23(15)31)19-10-20(25)24-27-22(14-30(24)13-19)18-5-7-29(8-6-18)12-17-3-4-17/h9-11,13-14,17-18H,3-8,12H2,1-2H3
InChIKeyMVKCJDVDYUPEJI-UHFFFAOYSA-N
XLogP4.39
TPSA50.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.52
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-[2-[1-(cyclopropylmethyl)piperidin-4-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-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine?
The IUPAC name of 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine (CID 170593629) is 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine.
What is the SMILES notation for 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine?
The canonical SMILES for 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine is Cc1cn2nc(-c3cc(F)c4nc(C5CCN(CC6CC6)CC5)cn4c3)cc(C)c2n1.
What is the InChIKey of 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine?
The InChIKey is MVKCJDVDYUPEJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN6/c1-15-9-21(28-31-11-16(2)26-23(15)31)19-10-20(25)24-27-22(14-30(24)13-19)18-5-7-29(8-6-18)12-17-3-4-17/h9-11,13-14,17-18H,3-8,12H2,1-2H3.
What are the key properties of 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine?
6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine has a molecular weight of 418.52 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[1-(cyclopropylmethyl)piperidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-6-yl]-2,8-dimethylimidazo[1,2-b]pyridazine is sourced from PubChem (CID 170593629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).