3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole

C38H60N8O2S2 — CID 157299311

IUPAC3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole
SMILESCc1nc(C)c(C)o1.Cc1nc(C)c(C)s1.Cc1nc(C)n(C)c1C.Cc1nn(C)c(C)c1C.Cc1noc(C)n1.Cc1sc(C)c(C)c1C
InChIInChI=1S/C8H12S.2C7H12N2.C6H9NO.C6H9NS.C4H6N2O/c1-5-6(2)8(4)9-7(5)3;1-5-6(2)9(4)7(3)8-5;1-5-6(2)8-9(4)7(5)3;2*1-4-5(2)8-6(3)7-4;1-3-5-4(2)7-6-3/h3*1-4H3;2*1-3H3;1-2H3
InChIKeyBBSCEJVEFMQWBA-UHFFFAOYSA-N
MW725.09 g/mol
LogP10.03
Rot. Bonds

About 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole

3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole (PubChem CID 157299311) has the molecular formula C38H60N8O2S2 and a molecular weight of 725.09 g/mol. Its IUPAC name is 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole.

Molecular Properties

Compound Name3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole
PubChem CID157299311
Molecular FormulaC38H60N8O2S2
Molecular Weight725.09 g/mol
Exact Mass724.43
IUPAC Name3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole
SMILESCc1nc(C)c(C)o1.Cc1nc(C)c(C)s1.Cc1nc(C)n(C)c1C.Cc1nn(C)c(C)c1C.Cc1noc(C)n1.Cc1sc(C)c(C)c1C
InChIInChI=1S/C8H12S.2C7H12N2.C6H9NO.C6H9NS.C4H6N2O/c1-5-6(2)8(4)9-7(5)3;1-5-6(2)9(4)7(3)8-5;1-5-6(2)8-9(4)7(5)3;2*1-4-5(2)8-6(3)7-4;1-3-5-4(2)7-6-3/h3*1-4H3;2*1-3H3;1-2H3
InChIKeyBBSCEJVEFMQWBA-UHFFFAOYSA-N
XLogP10.03
TPSA113.48 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms50
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500725.09
LogP ≤ 510.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole with MolForge

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Related Compounds

Bis(1,5-dimethyl-2,4-di(propan-2-yl)imidazole);1,4-dimethyl-3,5-di(propan-2-yl)pyrazole;bis(2,4-dimethyl-3,5-di(propan-2-yl)thiophene);3,4-dimethyl-2,5-di(propan-2-yl)thiophene;3,5-di(propan-2-yl)-1,2,4-oxadiazole;bis(4-methyl-2,5-di(propan-2-yl)-1,3-oxazole);bis(5-methyl-2,4-di(propan-2-yl)-1,3-oxazole);bis(4-methyl-2,5-di(propan-2-yl)-1,3-thiazole);bis(5-methyl-2,4-di(propan-2-yl)-1,3-thiazole);bis(1,2,4-trimethyl-3,5-di(propan-2-yl)pyrrole);1,3,4-trimethyl-2,5-di(propan-2-yl)pyrrole
CID 157392256
1,2,3,4,5-Pentamethylpyrrole;tris(1,2,4,5-tetramethylimidazole);bis(1,3,4,5-tetramethylpyrazole);bis(2,4,5-trimethyl-1,3-oxazole);bis(2,4,5-trimethyl-1,3-thiazole)
CID 157558308
4-Tert-butyl-3,5-dimethyl-1,2-oxazole;4,5-ditert-butyl-1,2-dimethylimidazole;4,5-ditert-butyl-1,3-dimethylpyrazole;4,5-ditert-butyl-2-methyl-1,3-oxazole;4,5-ditert-butyl-2-methyl-1,3-thiazole;4,5-ditert-butyl-3-methyl-1,2-thiazole;4,5-ditert-butyl-1-methyltriazole;4,5-ditert-butylthiadiazole
CID 157585514
1,2,3,4,5-Pentamethylpyrrole;tetrakis(1,2,4,5-tetramethylimidazole);3,4,5,6-tetramethylpyridazine;bis(2,4,5-trimethyl-1,3-oxazole);2,4,5-trimethyl-1,3-thiazole
CID 157592169
2,5-Dimethyl-4-propan-2-yl-1,3-oxazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;4,5-dimethyl-3-propan-2-yl-1,2-oxazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-3-propan-2-yl-1,2-thiazole;ethane;2-methylpropane;1,2,3,4-tetramethyl-5-propan-2-ylpyrrole;1,2,4-trimethyl-5-propan-2-ylimidazole;1,2,5-trimethyl-4-propan-2-ylimidazole;1,4,5-trimethyl-2-propan-2-ylimidazole;1,3,4-trimethyl-5-propan-2-ylpyrazole;1,4,5-trimethyl-3-propan-2-ylpyrazole;3,4,5-trimethyl-1-propan-2-ylpyrazole
CID 157647350
2,5-Dimethyl-4-propan-2-yl-1,3-oxazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;4,5-dimethyl-3-propan-2-yl-1,2-oxazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-3-propan-2-yl-1,2-thiazole;1,4-dimethyl-5-propan-2-yltriazole;1,5-dimethyl-3-propan-2-yl-1,2,4-triazole;1,5-dimethyl-4-propan-2-yltriazole;2,4-dimethyl-5-propan-2-yltriazole;3,5-dimethyl-1-propan-2-yl-1,2,4-triazole;4,5-dimethyl-1-propan-2-yltriazole;4,5-dimethyl-2-propan-2-yltriazole;1-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yltetrazole;5-methyl-1-propan-2-yltetrazole;5-methyl-2-propan-2-yltetrazole;1,2,3,4-tetramethyl-5-propan-2-ylpyrrole;1,2,4-trimethyl-5-propan-2-ylimidazole;1,2,5-trimethyl-4-propan-2-ylimidazole;1,4,5-trimethyl-2-propan-2-ylimidazole;1,3,4-trimethyl-5-propan-2-ylpyrazole;1,4,5-trimethyl-3-propan-2-ylpyrazole;3,4,5-trimethyl-1-propan-2-ylpyrazole
CID 157779007
2,4-Dimethyl-5-propan-2-yl-1,3-oxazole;2,5-dimethyl-4-propan-2-yl-1,3-oxazole;3,4-dimethyl-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-4-propan-2-yl-1,2-oxazole;4,5-dimethyl-2-propan-2-yl-1,3-oxazole;4,5-dimethyl-3-propan-2-yl-1,2-oxazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;3,5-dimethyl-4-propan-2-yl-1,2-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;4,5-dimethyl-3-propan-2-yl-1,2-thiazole;propane;1,2,3,4-tetramethyl-5-propan-2-ylpyrrole;1,2,3,5-tetramethyl-4-propan-2-ylpyrrole;2,3,4,5-tetramethyl-1-propan-2-ylpyrrole;1,3,4,5-tetramethylpyrazole;1,2,4-trimethyl-5-propan-2-ylimidazole;1,2,5-trimethyl-4-propan-2-ylimidazole;1,4,5-trimethyl-2-propan-2-ylimidazole;2,4,5-trimethyl-1-propan-2-ylimidazole;1,3,4-trimethyl-5-propan-2-ylpyrazole;1,4,5-trimethyl-3-propan-2-ylpyrazole;3,4,5-trimethyl-1-propan-2-ylpyrazole
CID 157887460
1,2,3,4,5-pentamethyl-2H-imidazole-1,3-diium;1,2,3,5,6-pentamethylpyrazin-1-ium;1,3,4,5,6-pentamethylpyridazin-1-ium;1,2,4,5,6-pentamethylpyrimidin-1-ium;2,3,4,5-tetramethyl-1,3-oxazol-3-ium;2,3,4,5-tetramethyl-1,3-thiazol-3-ium;1,3,4,5-tetramethyl-1,2,4-triazol-4-ium
CID 158009225
5-Tert-butyl-2,4-dimethyl-1,3-oxazole;1-tert-butyl-2,4,5-trimethylimidazole;4-tert-butyl-1,2,5-trimethylimidazole;5-tert-butyl-1,2,4-trimethylimidazole;4-tert-butyl-1,3,5-trimethylpyrazole;2-tert-butyl-3,4,5-trimethylthiophene
CID 158142311
1,2,3,4,5,6-Hexamethylpyridin-1-ium;1,2,3,4,5-pentamethylimidazol-1-ium;1,2,3,5,6-pentamethylpyrazin-1-ium;1,2,3,4,5-pentamethylpyrazol-2-ium;1,3,4,5,6-pentamethylpyridazin-1-ium;1,2,4,5,6-pentamethylpyrimidin-1-ium;2,3,4,5-tetramethyl-1,3-oxazol-3-ium;2,3,4,5-tetramethyl-1,3-thiazol-3-ium;1,3,4,5-tetramethyl-1,2,4-triazol-4-ium
CID 158178496
2,3,4,5,6-Pentamethyl-1-propan-2-ylpyridin-1-ium;1,2,4,5-tetramethyl-3-propan-2-ylimidazol-1-ium;2,3,5,6-tetramethyl-1-propan-2-ylpyrazin-1-ium;2,3,4,5-tetramethyl-1-propan-2-ylpyrazol-2-ium;3,4,5,6-tetramethyl-1-propan-2-ylpyridazin-1-ium;2,4,5,6-tetramethyl-1-propan-2-ylpyrimidin-1-ium;2,4,5-trimethyl-3-propan-2-yl-1,3-oxazol-3-ium;2,4,5-trimethyl-3-propan-2-yl-1,3-thiazol-3-ium;1,3,5-trimethyl-4-propan-2-yl-1,2,4-triazol-4-ium
CID 158302054
1,2,3,5,6-Pentamethylpyrazin-1-ium;1,2,3,4,5-pentamethylpyrazol-2-ium;1,3,4,5,6-pentamethylpyridazin-1-ium;1,2,4,5,6-pentamethylpyrimidin-1-ium;2,3,4,5-tetramethyl-1,3-oxazol-3-ium;2,3,4,5-tetramethyl-1,3-thiazol-3-ium;1,3,4,5-tetramethyl-1,2,4-triazol-4-ium
CID 158407638

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole?
The IUPAC name of 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole (CID 157299311) is 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole.
What is the SMILES notation for 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole?
The canonical SMILES for 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole is Cc1nc(C)c(C)o1.Cc1nc(C)c(C)s1.Cc1nc(C)n(C)c1C.Cc1nn(C)c(C)c1C.Cc1noc(C)n1.Cc1sc(C)c(C)c1C.
What is the InChIKey of 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole?
The InChIKey is BBSCEJVEFMQWBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12S.2C7H12N2.C6H9NO.C6H9NS.C4H6N2O/c1-5-6(2)8(4)9-7(5)3;1-5-6(2)9(4)7(3)8-5;1-5-6(2)8-9(4)7(5)3;2*1-4-5(2)8-6(3)7-4;1-3-5-4(2)7-6-3/h3*1-4H3;2*1-3H3;1-2H3.
What are the key properties of 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole?
3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole has a molecular weight of 725.09 g/mol, XLogP of 10.03, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1,2,4-oxadiazole;1,2,4,5-tetramethylimidazole;1,3,4,5-tetramethylpyrazole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-oxazole;2,4,5-trimethyl-1,3-thiazole is sourced from PubChem (CID 157299311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).