2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene

C57H83N17O5S — CID 158110502

IUPAC2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene
SMILESCC(C)c1cccs1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cnon1.CC(C)c1cocn1.CC(C)c1ncc[nH]1.CC(C)c1ncno1.CC(C)c1ncon1.CC(C)c1nnco1
InChIInChI=1S/2C9H11N3.C7H10S.C6H10N2.C6H9NO.4C5H8N2O/c1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;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;1-4(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/h2*3-7H,1-2H3;3-6H,1-2H3;3-5H,1-2H3,(H,7,8);3-5H,1-2H3;4*3-4H,1-2H3
InChIKeyFQJHJGURQVOFAG-UHFFFAOYSA-N
MW1118.47 g/mol
LogP14.68
Rot. Bonds9

About 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene

2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene (PubChem CID 158110502) has the molecular formula C57H83N17O5S and a molecular weight of 1118.47 g/mol. Its IUPAC name is 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene.

Molecular Properties

Compound Name2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene
PubChem CID158110502
Molecular FormulaC57H83N17O5S
Molecular Weight1118.47 g/mol
Exact Mass1117.65
IUPAC Name2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene
SMILESCC(C)c1cccs1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cnon1.CC(C)c1cocn1.CC(C)c1ncc[nH]1.CC(C)c1ncno1.CC(C)c1ncon1.CC(C)c1nnco1
InChIInChI=1S/2C9H11N3.C7H10S.C6H10N2.C6H9NO.4C5H8N2O/c1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;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;1-4(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/h2*3-7H,1-2H3;3-6H,1-2H3;3-5H,1-2H3,(H,7,8);3-5H,1-2H3;4*3-4H,1-2H3
InChIKeyFQJHJGURQVOFAG-UHFFFAOYSA-N
XLogP14.68
TPSA270.77 Ų
H-Bond Donors1
H-Bond Acceptors22
Rotatable Bonds9
Heavy Atoms80
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001118.47
LogP ≤ 514.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1022

Analyze 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene with MolForge

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Related Compounds

2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 157175362
1-methyl-2-propan-2-ylimidazole;1-methyl-4-propan-2-ylimidazole;1-methyl-3-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;bis(4-propan-2-yl-1,3-oxazole);5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyrimidine;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3-thiazole
CID 160513232
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
2-propan-2-yl-1H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-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;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 161795100

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene?
The IUPAC name of 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene (CID 158110502) is 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene.
What is the SMILES notation for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene?
The canonical SMILES for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene is CC(C)c1cccs1.CC(C)c1cn2cccnc2n1.CC(C)c1cn2ccncc2n1.CC(C)c1cnon1.CC(C)c1cocn1.CC(C)c1ncc[nH]1.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-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene?
The InChIKey is FQJHJGURQVOFAG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H11N3.C7H10S.C6H10N2.C6H9NO.4C5H8N2O/c1-7(2)8-6-12-4-3-10-5-9(12)11-8;1-7(2)8-6-12-5-3-4-10-9(12)11-8;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;1-4(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/h2*3-7H,1-2H3;3-6H,1-2H3;3-5H,1-2H3,(H,7,8);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-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene?
2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene has a molecular weight of 1118.47 g/mol, XLogP of 14.68, 9 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylimidazo[1,2-a]pyrazine;2-propan-2-ylimidazo[1,2-a]pyrimidine;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;2-propan-2-ylthiophene is sourced from PubChem (CID 158110502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).