2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)

C79H115N25O5S2 — CID 161245919

About 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)

2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine) (PubChem CID 161245919) has the molecular formula C79H115N25O5S2 and a molecular weight of 1559.09 g/mol. Its IUPAC name is 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine).

Molecular Properties

• Compound Name: 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)
• PubChem CID: 161245919
• Molecular Formula: C79H115N25O5S2
• Molecular Weight: 1559.09 g/mol
• Exact Mass: 1557.90
• IUPAC Name: 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)
• SMILES: CC(C)c1cccs1.CC(C)c1cn2ccncc2n1.CC(C)c1cnon1.CC(C)c1cocn1.CC(C)c1n[nH]c2c1CCC2.CC(C)c1nc2ncccn2n1.CC(C)c1nc2ncccn2n1.CC(C)c1ncc[nH]1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncon1.CC(C)c1nnco1
• InChI: InChI=1S/C9H11N3.C9H14N2.2C8H10N4.C7H10S.C6H10N2.C6H9NO.C6H9NS.4C5H8N2O/c1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-6(2)9-7-4-3-5-8(7)10-11-9;2*1-6(2)7-10-8-9-4-3-5-12(8)11-7;1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-3-6-8-7-5/h3-7H,1-2H3;6H,3-5H2,1-2H3,(H,10,11);2*3-6H,1-2H3;3-6H,1-2H3;3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3;4*3-4H,1-2H3
• InChIKey: VAQDGERGNCKGGF-UHFFFAOYSA-N
• XLogP: 19.61
• TPSA: 368.31 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 30
• Rotatable Bonds: 12
• Heavy Atoms: 111
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1559.09
LogP ≤ 5	19.61
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)?

The IUPAC name of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine) (CID 161245919) is 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine).

What is the SMILES notation for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)?

The canonical SMILES for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine) is CC(C)c1cccs1.CC(C)c1cn2ccncc2n1.CC(C)c1cnon1.CC(C)c1cocn1.CC(C)c1n[nH]c2c1CCC2.CC(C)c1nc2ncccn2n1.CC(C)c1nc2ncccn2n1.CC(C)c1ncc[nH]1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncon1.CC(C)c1nnco1.

What is the InChIKey of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)?

The InChIKey is VAQDGERGNCKGGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3.C9H14N2.2C8H10N4.C7H10S.C6H10N2.C6H9NO.C6H9NS.4C5H8N2O/c1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-6(2)9-7-4-3-5-8(7)10-11-9;2*1-6(2)7-10-8-9-4-3-5-12(8)11-7;1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-3-6-8-7-5/h3-7H,1-2H3;6H,3-5H2,1-2H3,(H,10,11);2*3-6H,1-2H3;3-6H,1-2H3;3-5H,1-2H3,(H,7,8);2*3-5H,1-2H3;4*3-4H,1-2H3.

What are the key properties of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine)?

2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine) has a molecular weight of 1559.09 g/mol, XLogP of 19.61, 12 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2,5-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;bis(2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine) is sourced from PubChem (CID 161245919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).