3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine

C112H113N45O3S6 — CID 157246391

About 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine

3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 157246391) has the molecular formula C112H113N45O3S6 and a molecular weight of 2329.85 g/mol. Its IUPAC name is 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

• Compound Name: 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine
• PubChem CID: 157246391
• Molecular Formula: C112H113N45O3S6
• Molecular Weight: 2329.85 g/mol
• Exact Mass: 2327.84
• IUPAC Name: 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine
• SMILES: CC(C)Cc1cc(Nc2nccn3c(-c4cnn(C)c4)cnc23)sn1.CCOC(=O)N1CCCC(c2cc(Nc3nccn4c(-c5cnn(C)c5)cnc34)sn2)C1.Cn1cc(-c2cnc3c(Nc4cc(-c5ccccc5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C(C)(C)C)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCCN(C(N)=O)C5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-c5ccccn5)s4)nccn23)cn1
• InChI: InChI=1S/C21H24N8O2S.C19H21N9OS.2C19H15N7S.2C17H19N7S/c1-3-31-21(30)28-7-4-5-14(13-28)16-9-18(32-26-16)25-19-20-23-11-17(29(20)8-6-22-19)15-10-24-27(2)12-15;1-26-10-13(8-23-26)15-9-22-18-17(21-4-6-28(15)18)24-16-7-14(25-30-16)12-3-2-5-27(11-12)19(20)29;1-25-12-13(10-23-25)15-11-22-19-18(21-8-9-26(15)19)24-17-6-5-16(27-17)14-4-2-3-7-20-14;1-25-12-14(10-22-25)16-11-21-19-18(20-7-8-26(16)19)23-17-9-15(24-27-17)13-5-3-2-4-6-13;1-17(2,3)13-7-14(25-22-13)21-15-16-19-9-12(24(16)6-5-18-15)11-8-20-23(4)10-11;1-11(2)6-13-7-15(25-22-13)21-16-17-19-9-14(24(17)5-4-18-16)12-8-20-23(3)10-12/h6,8-12,14H,3-5,7,13H2,1-2H3,(H,22,25);4,6-10,12H,2-3,5,11H2,1H3,(H2,20,29)(H,21,24);2-12H,1H3,(H,21,24);2-12H,1H3,(H,20,23);5-10H,1-4H3,(H,18,21);4-5,7-11H,6H2,1-3H3,(H,18,21)
• InChIKey: AVUYOLUIOXCXLV-UHFFFAOYSA-N
• XLogP: 21.40
• TPSA: 513.45 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 51
• Rotatable Bonds: 25
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2329.85
LogP ≤ 5	21.40
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	51

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine?

The IUPAC name of 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine (CID 157246391) is 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine.

What is the SMILES notation for 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine?

The canonical SMILES for 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine is CC(C)Cc1cc(Nc2nccn3c(-c4cnn(C)c4)cnc23)sn1.CCOC(=O)N1CCCC(c2cc(Nc3nccn4c(-c5cnn(C)c5)cnc34)sn2)C1.Cn1cc(-c2cnc3c(Nc4cc(-c5ccccc5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C(C)(C)C)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4cc(C5CCCN(C(N)=O)C5)ns4)nccn23)cn1.Cn1cc(-c2cnc3c(Nc4ccc(-c5ccccn5)s4)nccn23)cn1.

What is the InChIKey of 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine?

The InChIKey is AVUYOLUIOXCXLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N8O2S.C19H21N9OS.2C19H15N7S.2C17H19N7S/c1-3-31-21(30)28-7-4-5-14(13-28)16-9-18(32-26-16)25-19-20-23-11-17(29(20)8-6-22-19)15-10-24-27(2)12-15;1-26-10-13(8-23-26)15-9-22-18-17(21-4-6-28(15)18)24-16-7-14(25-30-16)12-3-2-5-27(11-12)19(20)29;1-25-12-13(10-23-25)15-11-22-19-18(21-8-9-26(15)19)24-17-6-5-16(27-17)14-4-2-3-7-20-14;1-25-12-14(10-22-25)16-11-21-19-18(20-7-8-26(16)19)23-17-9-15(24-27-17)13-5-3-2-4-6-13;1-17(2,3)13-7-14(25-22-13)21-15-16-19-9-12(24(16)6-5-18-15)11-8-20-23(4)10-11;1-11(2)6-13-7-15(25-22-13)21-16-17-19-9-14(24(17)5-4-18-16)12-8-20-23(3)10-12/h6,8-12,14H,3-5,7,13H2,1-2H3,(H,22,25);4,6-10,12H,2-3,5,11H2,1H3,(H2,20,29)(H,21,24);2-12H,1H3,(H,21,24);2-12H,1H3,(H,20,23);5-10H,1-4H3,(H,18,21);4-5,7-11H,6H2,1-3H3,(H,18,21).

What are the key properties of 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine?

3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 2329.85 g/mol, XLogP of 21.40, 25 rotatable bonds, 7 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for 3-tert-butyl-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;ethyl 3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxylate;3-(2-methylpropyl)-N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-1,2-thiazol-5-amine;3-[5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-1,2-thiazol-3-yl]piperidine-1-carboxamide;N-[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]-3-phenyl-1,2-thiazol-5-amine;3-(1-methylpyrazol-4-yl)-N-(5-pyridin-2-ylthiophen-2-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 157246391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).