N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide

C28H23N5O3 — CID 55610449

About N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide

N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide (PubChem CID 55610449) has the molecular formula C28H23N5O3 and a molecular weight of 477.52 g/mol. Its IUPAC name is N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide
• PubChem CID: 55610449
• Molecular Formula: C28H23N5O3
• Molecular Weight: 477.52 g/mol
• Exact Mass: 477.18
• IUPAC Name: N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide
• SMILES: Cc1cccn2cc(COc3ccc(C(=O)Nc4cccc(NC(=O)c5ccncc5)c4)cc3)nc12
• InChI: InChI=1S/C28H23N5O3/c1-19-4-3-15-33-17-24(30-26(19)33)18-36-25-9-7-20(8-10-25)27(34)31-22-5-2-6-23(16-22)32-28(35)21-11-13-29-14-12-21/h2-17H,18H2,1H3,(H,31,34)(H,32,35)
• InChIKey: RXMLSHFUJJGVRB-UHFFFAOYSA-N
• XLogP: 5.12
• TPSA: 97.62 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	477.52
LogP ≤ 5	5.12
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide?

The IUPAC name of N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide (CID 55610449) is N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide.

What is the SMILES notation for N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide?

The canonical SMILES for N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide is Cc1cccn2cc(COc3ccc(C(=O)Nc4cccc(NC(=O)c5ccncc5)c4)cc3)nc12.

What is the InChIKey of N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide?

The InChIKey is RXMLSHFUJJGVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23N5O3/c1-19-4-3-15-33-17-24(30-26(19)33)18-36-25-9-7-20(8-10-25)27(34)31-22-5-2-6-23(16-22)32-28(35)21-11-13-29-14-12-21/h2-17H,18H2,1H3,(H,31,34)(H,32,35).

What are the key properties of N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide?

N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide has a molecular weight of 477.52 g/mol, XLogP of 5.12, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[[4-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzoyl]amino]phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 55610449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).