imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone

C21H23N5O2 — CID 129332290

About imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone

imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone (PubChem CID 129332290) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone.

Molecular Properties

• Compound Name: imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
• PubChem CID: 129332290
• Molecular Formula: C21H23N5O2
• Molecular Weight: 377.45 g/mol
• Exact Mass: 377.19
• IUPAC Name: imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone
• SMILES: O=C(c1cnc2ccccn12)N1CC[C@H](Oc2cccnc2N2CCCC2)C1
• InChI: InChI=1S/C21H23N5O2/c27-21(17-14-23-19-7-1-2-12-26(17)19)25-13-8-16(15-25)28-18-6-5-9-22-20(18)24-10-3-4-11-24/h1-2,5-7,9,12,14,16H,3-4,8,10-11,13,15H2/t16-/m0/s1
• InChIKey: KRCWQZHDGXPEJQ-INIZCTEOSA-N
• XLogP: 2.62
• TPSA: 62.97 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	377.45
LogP ≤ 5	2.62
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?

The IUPAC name of imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone (CID 129332290) is imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone.

What is the SMILES notation for imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?

The canonical SMILES for imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone is O=C(c1cnc2ccccn12)N1CC[C@H](Oc2cccnc2N2CCCC2)C1.

What is the InChIKey of imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?

The InChIKey is KRCWQZHDGXPEJQ-INIZCTEOSA-N. The full InChI is InChI=1S/C21H23N5O2/c27-21(17-14-23-19-7-1-2-12-26(17)19)25-13-8-16(15-25)28-18-6-5-9-22-20(18)24-10-3-4-11-24/h1-2,5-7,9,12,14,16H,3-4,8,10-11,13,15H2/t16-/m0/s1.

What are the key properties of imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone?

imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone has a molecular weight of 377.45 g/mol, XLogP of 2.62, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for imidazo[1,2-a]pyridin-3-yl-[(3S)-3-[(2-pyrrolidin-1-yl-3-pyridinyl)oxy]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 129332290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).