6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid

C91H82BBr3F7N23O2 — CID 158103760

About 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid

6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid (PubChem CID 158103760) has the molecular formula C91H82BBr3F7N23O2 and a molecular weight of 1913.33 g/mol. Its IUPAC name is 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid.

Molecular Properties

• Compound Name: 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid
• PubChem CID: 158103760
• Molecular Formula: C91H82BBr3F7N23O2
• Molecular Weight: 1913.33 g/mol
• Exact Mass: 1909.46
• IUPAC Name: 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid
• SMILES: C=C(C)c1cnc2c(Br)nc(Br)cn12.C=C(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(-c3cncc(F)c3)cn12.C=C(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(Br)cn12.CC(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(-c3cncc(F)c3)cn12.NCCc1c[nH]c2cccc(F)c12.OB(O)c1cncc(F)c1
• InChI: InChI=1S/C24H22F2N6.C24H20F2N6.C19H17BrFN5.C10H11FN2.C9H7Br2N3.C5H5BFNO2/c2*1-14(2)21-12-30-24-23(31-20(13-32(21)24)16-8-17(25)11-27-9-16)28-7-6-15-10-29-19-5-3-4-18(26)22(15)19;1-11(2)15-9-24-19-18(25-16(20)10-26(15)19)22-7-6-12-8-23-14-5-3-4-13(21)17(12)14;11-8-2-1-3-9-10(8)7(4-5-12)6-13-9;1-5(2)6-3-12-9-8(11)13-7(10)4-14(6)9;7-5-1-4(6(9)10)2-8-3-5/h3-5,8-14,29H,6-7H2,1-2H3,(H,28,31);3-5,8-13,29H,1,6-7H2,2H3,(H,28,31);3-5,8-10,23H,1,6-7H2,2H3,(H,22,25);1-3,6,13H,4-5,12H2;3-4H,1H2,2H3;1-3,9-10H
• InChIKey: FPOUJQUNQHHGBB-UHFFFAOYSA-N
• XLogP: 19.36
• TPSA: 325.16 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 21
• Rotatable Bonds: 21
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1913.33
LogP ≤ 5	19.36
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid?

The IUPAC name of 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid (CID 158103760) is 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid.

What is the SMILES notation for 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid?

The canonical SMILES for 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid is C=C(C)c1cnc2c(Br)nc(Br)cn12.C=C(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(-c3cncc(F)c3)cn12.C=C(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(Br)cn12.CC(C)c1cnc2c(NCCc3c[nH]c4cccc(F)c34)nc(-c3cncc(F)c3)cn12.NCCc1c[nH]c2cccc(F)c12.OB(O)c1cncc(F)c1.

What is the InChIKey of 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid?

The InChIKey is FPOUJQUNQHHGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22F2N6.C24H20F2N6.C19H17BrFN5.C10H11FN2.C9H7Br2N3.C5H5BFNO2/c2*1-14(2)21-12-30-24-23(31-20(13-32(21)24)16-8-17(25)11-27-9-16)28-7-6-15-10-29-19-5-3-4-18(26)22(15)19;1-11(2)15-9-24-19-18(25-16(20)10-26(15)19)22-7-6-12-8-23-14-5-3-4-13(21)17(12)14;11-8-2-1-3-9-10(8)7(4-5-12)6-13-9;1-5(2)6-3-12-9-8(11)13-7(10)4-14(6)9;7-5-1-4(6(9)10)2-8-3-5/h3-5,8-14,29H,6-7H2,1-2H3,(H,28,31);3-5,8-13,29H,1,6-7H2,2H3,(H,28,31);3-5,8-10,23H,1,6-7H2,2H3,(H,22,25);1-3,6,13H,4-5,12H2;3-4H,1H2,2H3;1-3,9-10H.

What are the key properties of 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid?

6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid has a molecular weight of 1913.33 g/mol, XLogP of 19.36, 21 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;6,8-dibromo-3-prop-1-en-2-ylimidazo[1,2-a]pyrazine;2-(4-fluoro-1H-indol-3-yl)ethanamine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-propan-2-ylimidazo[1,2-a]pyrazin-8-amine;N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-6-(5-fluoro-3-pyridinyl)-3-prop-1-en-2-ylimidazo[1,2-a]pyrazin-8-amine;(5-fluoro-3-pyridinyl)boronic acid is sourced from PubChem (CID 158103760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).