3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol

C126H126ClF2N31O — CID 157237039

About 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol

3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol (PubChem CID 157237039) has the molecular formula C126H126ClF2N31O and a molecular weight of 2164.06 g/mol. Its IUPAC name is 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol.

Molecular Properties

• Compound Name: 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol
• PubChem CID: 157237039
• Molecular Formula: C126H126ClF2N31O
• Molecular Weight: 2164.06 g/mol
• Exact Mass: 2162.04
• IUPAC Name: 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol
• SMILES: CC(CO)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(F)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(C)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(Cl)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(F)c3)cn12.[C-]#[N+]c1cncc(-c2cn3c(C(C)CC)cnc3c(NCCc3c[nH]c4ccccc34)n2)c1
• InChI: InChI=1S/C26H25N7.C26H28N6.C25H25ClN6.C25H25FN6.C24H23FN6O/c1-4-17(2)24-15-31-26-25(29-10-9-18-13-30-22-8-6-5-7-21(18)22)32-23(16-33(24)26)19-11-20(27-3)14-28-12-19;1-4-18(3)24-15-30-26-25(28-10-9-19-14-29-22-8-6-5-7-21(19)22)31-23(16-32(24)26)20-11-17(2)12-27-13-20;2*1-3-16(2)23-14-30-25-24(28-9-8-17-12-29-21-7-5-4-6-20(17)21)31-22(15-32(23)25)18-10-19(26)13-27-11-18;1-15(14-32)22-12-29-24-23(27-7-6-16-10-28-20-5-3-2-4-19(16)20)30-21(13-31(22)24)17-8-18(25)11-26-9-17/h5-8,11-17,30H,4,9-10H2,1-2H3,(H,29,32);5-8,11-16,18,29H,4,9-10H2,1-3H3,(H,28,31);2*4-7,10-16,29H,3,8-9H2,1-2H3,(H,28,31);2-5,8-13,15,28,32H,6-7,14H2,1H3,(H,27,30)
• InChIKey: AUTFYDIZPPQXSQ-UHFFFAOYSA-N
• XLogP: 27.58
• TPSA: 379.09 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 26
• Rotatable Bonds: 35
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2164.06
LogP ≤ 5	27.58
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol?

The IUPAC name of 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol (CID 157237039) is 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol.

What is the SMILES notation for 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol?

The canonical SMILES for 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol is CC(CO)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(F)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(C)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(Cl)c3)cn12.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)nc(-c3cncc(F)c3)cn12.[C-]#[N+]c1cncc(-c2cn3c(C(C)CC)cnc3c(NCCc3c[nH]c4ccccc34)n2)c1.

What is the InChIKey of 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol?

The InChIKey is AUTFYDIZPPQXSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N7.C26H28N6.C25H25ClN6.C25H25FN6.C24H23FN6O/c1-4-17(2)24-15-31-26-25(29-10-9-18-13-30-22-8-6-5-7-21(18)22)32-23(16-33(24)26)19-11-20(27-3)14-28-12-19;1-4-18(3)24-15-30-26-25(28-10-9-19-14-29-22-8-6-5-7-21(19)22)31-23(16-32(24)26)20-11-17(2)12-27-13-20;2*1-3-16(2)23-14-30-25-24(28-9-8-17-12-29-21-7-5-4-6-20(17)21)31-22(15-32(23)25)18-10-19(26)13-27-11-18;1-15(14-32)22-12-29-24-23(27-7-6-16-10-28-20-5-3-2-4-19(16)20)30-21(13-31(22)24)17-8-18(25)11-26-9-17/h5-8,11-17,30H,4,9-10H2,1-2H3,(H,29,32);5-8,11-16,18,29H,4,9-10H2,1-3H3,(H,28,31);2*4-7,10-16,29H,3,8-9H2,1-2H3,(H,28,31);2-5,8-13,15,28,32H,6-7,14H2,1H3,(H,27,30).

What are the key properties of 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol?

3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol has a molecular weight of 2164.06 g/mol, XLogP of 27.58, 35 rotatable bonds, 11 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 3-butan-2-yl-6-(5-chloro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-isocyano-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;3-butan-2-yl-N-[2-(1H-indol-3-yl)ethyl]-6-(5-methyl-3-pyridinyl)imidazo[1,2-a]pyrazin-8-amine;2-[6-(5-fluoro-3-pyridinyl)-8-[2-(1H-indol-3-yl)ethylamino]imidazo[1,2-a]pyrazin-3-yl]propan-1-ol is sourced from PubChem (CID 157237039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).