[4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol

C₂₁H₁₇N₃O — CID 155541112

About [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol

[4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol (PubChem CID 155541112) has the molecular formula C₂₁H₁₇N₃O and a molecular weight of 327.39 g/mol. Its IUPAC name is [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol.

Molecular Properties

• Compound Name: [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol
• PubChem CID: 155541112
• Molecular Formula: C₂₁H₁₇N₃O
• Molecular Weight: 327.39 g/mol
• Exact Mass: 327.14
• IUPAC Name: [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol
• SMILES: OCc1ccc(-c2cnc3cnc(/C=C/c4ccccc4)cn23)cc1
• InChI: InChI=1S/C21H17N3O/c25-15-17-6-9-18(10-7-17)20-12-23-21-13-22-19(14-24(20)21)11-8-16-4-2-1-3-5-16/h1-14,25H,15H2/b11-8+
• InChIKey: AIETUOHBMOKGEY-DHZHZOJOSA-N
• XLogP: 4.06
• TPSA: 50.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	327.39
LogP ≤ 5	4.06
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?

The IUPAC name of [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol (CID 155541112) is [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol.

What is the SMILES notation for [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?

The canonical SMILES for [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol is OCc1ccc(-c2cnc3cnc(/C=C/c4ccccc4)cn23)cc1.

What is the InChIKey of [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?

The InChIKey is AIETUOHBMOKGEY-DHZHZOJOSA-N. The full InChI is InChI=1S/C21H17N3O/c25-15-17-6-9-18(10-7-17)20-12-23-21-13-22-19(14-24(20)21)11-8-16-4-2-1-3-5-16/h1-14,25H,15H2/b11-8+.

What are the key properties of [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?

[4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol has a molecular weight of 327.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[6-[(E)-2-phenylethenyl]imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol is sourced from PubChem (CID 155541112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155541112 — identifiers, structure, computed properties (public domain)

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