3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine

C84H86FN15O — CID 158541875

About 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine

3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine (PubChem CID 158541875) has the molecular formula C84H86FN15O and a molecular weight of 1340.71 g/mol. Its IUPAC name is 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine.

Molecular Properties

• Compound Name: 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine
• PubChem CID: 158541875
• Molecular Formula: C84H86FN15O
• Molecular Weight: 1340.71 g/mol
• Exact Mass: 1339.71
• IUPAC Name: 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine
• SMILES: C#Cc1cncc(-c2cc(NCCc3c[nH]c4ccccc34)c3ncc(C(C)CC)n3c2)c1.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(C4CC4)c3)cn12.COCCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(F)c3)cn12
• InChI: InChI=1S/C29H31N5.C28H27N5.C27H28FN5O/c1-3-19(2)28-17-33-29-27(31-11-10-21-16-32-26-7-5-4-6-25(21)26)13-24(18-34(28)29)23-12-22(14-30-15-23)20-8-9-20;1-4-19(3)27-17-32-28-26(30-11-10-21-16-31-25-9-7-6-8-24(21)25)13-23(18-33(27)28)22-12-20(5-2)14-29-15-22;1-18(8-10-34-2)26-16-32-27-25(12-21(17-33(26)27)20-11-22(28)15-29-13-20)30-9-7-19-14-31-24-6-4-3-5-23(19)24/h4-7,12-20,31-32H,3,8-11H2,1-2H3;2,6-9,12-19,30-31H,4,10-11H2,1,3H3;3-6,11-18,30-31H,7-10H2,1-2H3
• InChIKey: HOPRUAZITKSKES-UHFFFAOYSA-N
• XLogP: 18.76
• TPSA: 183.26 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 13
• Rotatable Bonds: 24
• Heavy Atoms: 101
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1340.71
LogP ≤ 5	18.76
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine?

The IUPAC name of 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine (CID 158541875) is 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine.

What is the SMILES notation for 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine?

The canonical SMILES for 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine is C#Cc1cncc(-c2cc(NCCc3c[nH]c4ccccc34)c3ncc(C(C)CC)n3c2)c1.CCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(C4CC4)c3)cn12.COCCC(C)c1cnc2c(NCCc3c[nH]c4ccccc34)cc(-c3cncc(F)c3)cn12.

What is the InChIKey of 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine?

The InChIKey is HOPRUAZITKSKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H31N5.C28H27N5.C27H28FN5O/c1-3-19(2)28-17-33-29-27(31-11-10-21-16-32-26-7-5-4-6-25(21)26)13-24(18-34(28)29)23-12-22(14-30-15-23)20-8-9-20;1-4-19(3)27-17-32-28-26(30-11-10-21-16-31-25-9-7-6-8-24(21)25)13-23(18-33(27)28)22-12-20(5-2)14-29-15-22;1-18(8-10-34-2)26-16-32-27-25(12-21(17-33(26)27)20-11-22(28)15-29-13-20)30-9-7-19-14-31-24-6-4-3-5-23(19)24/h4-7,12-20,31-32H,3,8-11H2,1-2H3;2,6-9,12-19,30-31H,4,10-11H2,1,3H3;3-6,11-18,30-31H,7-10H2,1-2H3.

What are the key properties of 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine?

3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine has a molecular weight of 1340.71 g/mol, XLogP of 18.76, 24 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 3-butan-2-yl-6-(5-cyclopropyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;3-butan-2-yl-6-(5-ethynyl-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]imidazo[1,2-a]pyridin-8-amine;6-(5-fluoro-3-pyridinyl)-N-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxybutan-2-yl)imidazo[1,2-a]pyridin-8-amine is sourced from PubChem (CID 158541875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).