(3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone

C26H26N4O2 — CID 56503056

About (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone

(3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone (PubChem CID 56503056) has the molecular formula C26H26N4O2 and a molecular weight of 426.52 g/mol. Its IUPAC name is (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone.

Molecular Properties

• Compound Name: (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone
• PubChem CID: 56503056
• Molecular Formula: C26H26N4O2
• Molecular Weight: 426.52 g/mol
• Exact Mass: 426.21
• IUPAC Name: (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone
• SMILES: Cc1ccc2nc(COc3ccc(C(=O)N4CCC(Nc5ccccc5)C4)cc3)cn2c1
• InChI: InChI=1S/C26H26N4O2/c1-19-7-12-25-28-23(17-30(25)15-19)18-32-24-10-8-20(9-11-24)26(31)29-14-13-22(16-29)27-21-5-3-2-4-6-21/h2-12,15,17,22,27H,13-14,16,18H2,1H3
• InChIKey: DUMHHMFBSKOFHS-UHFFFAOYSA-N
• XLogP: 4.55
• TPSA: 58.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	426.52
LogP ≤ 5	4.55
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone?

The IUPAC name of (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone (CID 56503056) is (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone.

What is the SMILES notation for (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone?

The canonical SMILES for (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone is Cc1ccc2nc(COc3ccc(C(=O)N4CCC(Nc5ccccc5)C4)cc3)cn2c1.

What is the InChIKey of (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone?

The InChIKey is DUMHHMFBSKOFHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O2/c1-19-7-12-25-28-23(17-30(25)15-19)18-32-24-10-8-20(9-11-24)26(31)29-14-13-22(16-29)27-21-5-3-2-4-6-21/h2-12,15,17,22,27H,13-14,16,18H2,1H3.

What are the key properties of (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone?

(3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone has a molecular weight of 426.52 g/mol, XLogP of 4.55, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (3-anilinopyrrolidin-1-yl)-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone is sourced from PubChem (CID 56503056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).