3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate

C87H95N25O14 — CID 159125782

About 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate

3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate (PubChem CID 159125782) has the molecular formula C87H95N25O14 and a molecular weight of 1714.88 g/mol. Its IUPAC name is 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate.

Molecular Properties

• Compound Name: 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate
• PubChem CID: 159125782
• Molecular Formula: C87H95N25O14
• Molecular Weight: 1714.88 g/mol
• Exact Mass: 1713.75
• IUPAC Name: 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate
• SMILES: CN(CCOc1cccnc1CN)C(=O)OC(C)(C)C.CNCCOc1cccnc1CCC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(-c2ncco2)nc1N.Cc1cnc2ccc(-c3nc(C(=O)CCc4ncccc4OCCN(C)C(=O)OC(C)(C)C)c(N)nc3-c3ncco3)cn12.Cc1cnc2ccc(-c3nc(C(=O)O)c(N)nc3-c3ncco3)cn12
• InChI: InChI=1S/C31H34N8O5.C26H26N8O3.C16H12N6O3.C14H23N3O3/c1-19-17-35-24-11-8-20(18-39(19)24)25-27(29-34-13-15-43-29)37-28(32)26(36-25)22(40)10-9-21-23(7-6-12-33-21)42-16-14-38(5)30(41)44-31(2,3)4;1-16-14-31-21-8-5-17(15-34(16)21)22-24(26-30-11-13-37-26)33-25(27)23(32-22)19(35)7-6-18-20(4-3-9-29-18)36-12-10-28-2;1-8-6-19-10-3-2-9(7-22(8)10)11-12(15-18-4-5-25-15)21-14(17)13(20-11)16(23)24;1-14(2,3)20-13(18)17(4)8-9-19-12-6-5-7-16-11(12)10-15/h6-8,11-13,15,17-18H,9-10,14,16H2,1-5H3,(H2,32,37);3-5,8-9,11,13-15,28H,6-7,10,12H2,1-2H3,(H2,27,33);2-7H,1H3,(H2,17,21)(H,23,24);5-7H,8-10,15H2,1-4H3
• InChIKey: KGGHHRXIJTWMLW-UHFFFAOYSA-N
• XLogP: 11.76
• TPSA: 520.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 36
• Rotatable Bonds: 28
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1714.88
LogP ≤ 5	11.76
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate?

The IUPAC name of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate (CID 159125782) is 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate.

What is the SMILES notation for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate?

The canonical SMILES for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate is CN(CCOc1cccnc1CN)C(=O)OC(C)(C)C.CNCCOc1cccnc1CCC(=O)c1nc(-c2ccc3ncc(C)n3c2)c(-c2ncco2)nc1N.Cc1cnc2ccc(-c3nc(C(=O)CCc4ncccc4OCCN(C)C(=O)OC(C)(C)C)c(N)nc3-c3ncco3)cn12.Cc1cnc2ccc(-c3nc(C(=O)O)c(N)nc3-c3ncco3)cn12.

What is the InChIKey of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate?

The InChIKey is KGGHHRXIJTWMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H34N8O5.C26H26N8O3.C16H12N6O3.C14H23N3O3/c1-19-17-35-24-11-8-20(18-39(19)24)25-27(29-34-13-15-43-29)37-28(32)26(36-25)22(40)10-9-21-23(7-6-12-33-21)42-16-14-38(5)30(41)44-31(2,3)4;1-16-14-31-21-8-5-17(15-34(16)21)22-24(26-30-11-13-37-26)33-25(27)23(32-22)19(35)7-6-18-20(4-3-9-29-18)36-12-10-28-2;1-8-6-19-10-3-2-9(7-22(8)10)11-12(15-18-4-5-25-15)21-14(17)13(20-11)16(23)24;1-14(2,3)20-13(18)17(4)8-9-19-12-6-5-7-16-11(12)10-15/h6-8,11-13,15,17-18H,9-10,14,16H2,1-5H3,(H2,32,37);3-5,8-9,11,13-15,28H,6-7,10,12H2,1-2H3,(H2,27,33);2-7H,1H3,(H2,17,21)(H,23,24);5-7H,8-10,15H2,1-4H3.

What are the key properties of 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate?

3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate has a molecular weight of 1714.88 g/mol, XLogP of 11.76, 28 rotatable bonds, 6 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazine-2-carboxylic acid;1-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-[3-[2-(methylamino)ethoxy]-2-pyridinyl]propan-1-one;tert-butyl N-[2-[[2-[3-[3-amino-6-(3-methylimidazo[1,2-a]pyridin-6-yl)-5-(1,3-oxazol-2-yl)pyrazin-2-yl]-3-oxopropyl]-3-pyridinyl]oxy]ethyl]-N-methylcarbamate;tert-butyl N-[2-[[2-(aminomethyl)-3-pyridinyl]oxy]ethyl]-N-methylcarbamate is sourced from PubChem (CID 159125782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).