N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

C₂₈H₂₂N₄O₂ — CID 121363507

About N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide

N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (PubChem CID 121363507) has the molecular formula C₂₈H₂₂N₄O₂ and a molecular weight of 446.51 g/mol. Its IUPAC name is N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.

Molecular Properties

• Compound Name: N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
• PubChem CID: 121363507
• Molecular Formula: C₂₈H₂₂N₄O₂
• Molecular Weight: 446.51 g/mol
• Exact Mass: 446.17
• IUPAC Name: N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide
• SMILES: Cc1nc2ccccn2c1-c1cccc(CNC(=O)c2ccc3c(c2)OCc2cnccc2-3)c1
• InChI: InChI=1S/C28H22N4O2/c1-18-27(32-12-3-2-7-26(32)31-18)20-6-4-5-19(13-20)15-30-28(33)21-8-9-24-23-10-11-29-16-22(23)17-34-25(24)14-21/h2-14,16H,15,17H2,1H3,(H,30,33)
• InChIKey: XLANSXXNDRUZDV-UHFFFAOYSA-N
• XLogP: 5.19
• TPSA: 68.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	446.51
LogP ≤ 5	5.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?

The IUPAC name of N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide (CID 121363507) is N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide.

What is the SMILES notation for N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?

The canonical SMILES for N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is Cc1nc2ccccn2c1-c1cccc(CNC(=O)c2ccc3c(c2)OCc2cnccc2-3)c1.

What is the InChIKey of N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?

The InChIKey is XLANSXXNDRUZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22N4O2/c1-18-27(32-12-3-2-7-26(32)31-18)20-6-4-5-19(13-20)15-30-28(33)21-8-9-24-23-10-11-29-16-22(23)17-34-25(24)14-21/h2-14,16H,15,17H2,1H3,(H,30,33).

What are the key properties of N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide?

N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide has a molecular weight of 446.51 g/mol, XLogP of 5.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[[3-(2-methylimidazo[1,2-a]pyridin-3-yl)phenyl]methyl]-5H-chromeno[3,4-c]pyridine-8-carboxamide is sourced from PubChem (CID 121363507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 121363507 — identifiers, structure, computed properties (public domain)

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