2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone

C18H20N4O3 — CID 95108322

About 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone

2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone (PubChem CID 95108322) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone.

Molecular Properties

• Compound Name: 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone
• PubChem CID: 95108322
• Molecular Formula: C18H20N4O3
• Molecular Weight: 340.38 g/mol
• Exact Mass: 340.15
• IUPAC Name: 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone
• SMILES: CCOCC(=O)N1CC[C@@H](n2c(-c3ccoc3)nc3cccnc32)C1
• InChI: InChI=1S/C18H20N4O3/c1-2-24-12-16(23)21-8-5-14(10-21)22-17(13-6-9-25-11-13)20-15-4-3-7-19-18(15)22/h3-4,6-7,9,11,14H,2,5,8,10,12H2,1H3/t14-/m1/s1
• InChIKey: DSONNXOTZFAKOH-CQSZACIVSA-N
• XLogP: 2.50
• TPSA: 73.39 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	340.38
LogP ≤ 5	2.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone?

The IUPAC name of 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone (CID 95108322) is 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone.

What is the SMILES notation for 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone?

The canonical SMILES for 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone is CCOCC(=O)N1CC[C@@H](n2c(-c3ccoc3)nc3cccnc32)C1.

What is the InChIKey of 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone?

The InChIKey is DSONNXOTZFAKOH-CQSZACIVSA-N. The full InChI is InChI=1S/C18H20N4O3/c1-2-24-12-16(23)21-8-5-14(10-21)22-17(13-6-9-25-11-13)20-15-4-3-7-19-18(15)22/h3-4,6-7,9,11,14H,2,5,8,10,12H2,1H3/t14-/m1/s1.

What are the key properties of 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone?

2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone has a molecular weight of 340.38 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethoxy-1-[(3R)-3-[2-(furan-3-yl)imidazo[4,5-b]pyridin-3-yl]pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 95108322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).