6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione

C27H20N4O2 — CID 158751069

IUPAC6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione
SMILESO=C1CCC(=O)C(c2ccc(-c3ccn4c(-c5cccc6ncccc56)cnc4c3)cc2)N1
InChIInChI=1S/C27H20N4O2/c32-24-10-11-26(33)30-27(24)18-8-6-17(7-9-18)19-12-14-31-23(16-29-25(31)15-19)21-3-1-5-22-20(21)4-2-13-28-22/h1-9,12-16,27H,10-11H2,(H,30,33)
InChIKeyINMHTXKBKGWGGU-UHFFFAOYSA-N
MW432.48 g/mol
LogP4.74
Rot. Bonds3

About 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione

6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione (PubChem CID 158751069) has the molecular formula C27H20N4O2 and a molecular weight of 432.48 g/mol. Its IUPAC name is 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione.

Molecular Properties

Compound Name6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione
PubChem CID158751069
Molecular FormulaC27H20N4O2
Molecular Weight432.48 g/mol
Exact Mass432.16
IUPAC Name6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione
SMILESO=C1CCC(=O)C(c2ccc(-c3ccn4c(-c5cccc6ncccc56)cnc4c3)cc2)N1
InChIInChI=1S/C27H20N4O2/c32-24-10-11-26(33)30-27(24)18-8-6-17(7-9-18)19-12-14-31-23(16-29-25(31)15-19)21-3-1-5-22-20(21)4-2-13-28-22/h1-9,12-16,27H,10-11H2,(H,30,33)
InChIKeyINMHTXKBKGWGGU-UHFFFAOYSA-N
XLogP4.74
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.48
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione?
The IUPAC name of 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione (CID 158751069) is 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione.
What is the SMILES notation for 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione?
The canonical SMILES for 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione is O=C1CCC(=O)C(c2ccc(-c3ccn4c(-c5cccc6ncccc56)cnc4c3)cc2)N1.
What is the InChIKey of 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione?
The InChIKey is INMHTXKBKGWGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20N4O2/c32-24-10-11-26(33)30-27(24)18-8-6-17(7-9-18)19-12-14-31-23(16-29-25(31)15-19)21-3-1-5-22-20(21)4-2-13-28-22/h1-9,12-16,27H,10-11H2,(H,30,33).
What are the key properties of 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione?
6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione has a molecular weight of 432.48 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(3-quinolin-5-ylimidazo[1,2-a]pyridin-7-yl)phenyl]piperidine-2,5-dione is sourced from PubChem (CID 158751069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).