5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole
C168H274F2N32O11S2 — CID 158711469
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole
SMILESCC(C)(C)C1=CCN=N1.CC(C)(C)c1cc(C(C)(C)C)on1.CC(C)(C)c1cc(C(C)(F)F)no1.CC(C)(C)c1cocn1.CC(C)c1cc(C(C)C)on1.CC(C)c1ccno1.CC(C)c1cn(C)nn1.CC(C)c1cnco1.CC(C)c1nc(C2CC2)no1.CC(C)c1ncco1.CC(C)c1noc(C(C)C)n1.CC(C)n1cccn1.CCc1cc(C(C)C)on1.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)ccn1.Cc1cnc(C(C)C)s1.Cc1cnn(C(C)C)c1.Cc1nnc(C(C)(C)C)s1.Cc1occc1C(C)C.Cn1ccc(C(C)(C)C)c1.Cn1ccc(C(C)(C)C)n1.Cn1ccc(C(C)(C)C)n1
InChIInChI=1S/C11H19NO.C9H13F2NO.C9H15NO.C9H15N.C9H13N.C8H12N2O.C8H14N2O.3C8H14N2.C8H13NO.C8H12O.C7H12N2S.2C7H12N2.C7H11NO.C7H11NS.C6H11N3.C6H10N2.3C6H9NO/c1-10(2,3)8-7-9(13-12-8)11(4,5)6;1-8(2,3)7-5-6(12-13-7)9(4,10)11;1-6(2)8-5-9(7(3)4)11-10-8;1-9(2,3)8-5-6-10(4)7-8;1-7(2)9-4-5-10-8(3)6-9;1-5(2)8-9-7(10-11-8)6-3-4-6;1-5(2)7-9-8(6(3)4)11-10-7;2*1-8(2,3)7-5-6-10(4)9-7;1-6(2)8-5-9-10(4)7(8)3;1-4-7-5-8(6(2)3)10-9-7;1-6(2)8-4-5-9-7(8)3;1-5-8-9-6(10-5)7(2,3)4;1-6(2)9-5-7(3)4-8-9;1-7(2,3)6-4-5-8-9-6;1-7(2,3)6-4-9-5-8-6;1-5(2)7-8-4-6(3)9-7;1-5(2)6-4-9(3)8-7-6;1-6(2)8-5-3-4-7-8;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6/h7H,1-6H3;5H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;4-7H,1-3H3;5-6H,3-4H2,1-2H3;5-6H,1-4H3;3*5-6H,1-4H3;5-6H,4H2,1-3H3;4-6H,1-3H3;1-4H3;4-6H,1-3H3;4H,5H2,1-3H3;3*4-5H,1-3H3;3-6H,1-2H3;3*3-5H,1-2H3
InChIKeyIITWZDFWHGEXOQ-UHFFFAOYSA-N
MW3020.38 g/mol
LogP47.50
Rot. Bonds19
About 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole
5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole (PubChem CID 158711469) has the molecular formula C168H274F2N32O11S2 and a molecular weight of 3020.38 g/mol. Its IUPAC name is 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole.
Molecular Properties
| Compound Name | 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole |
|---|---|
| PubChem CID | 158711469 |
| Molecular Formula | C168H274F2N32O11S2 |
| Molecular Weight | 3020.38 g/mol |
| Exact Mass | 3018.13 |
| IUPAC Name | 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole |
| SMILES | CC(C)(C)C1=CCN=N1.CC(C)(C)c1cc(C(C)(C)C)on1.CC(C)(C)c1cc(C(C)(F)F)no1.CC(C)(C)c1cocn1.CC(C)c1cc(C(C)C)on1.CC(C)c1ccno1.CC(C)c1cn(C)nn1.CC(C)c1cnco1.CC(C)c1nc(C2CC2)no1.CC(C)c1ncco1.CC(C)c1noc(C(C)C)n1.CC(C)n1cccn1.CCc1cc(C(C)C)on1.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)ccn1.Cc1cnc(C(C)C)s1.Cc1cnn(C(C)C)c1.Cc1nnc(C(C)(C)C)s1.Cc1occc1C(C)C.Cn1ccc(C(C)(C)C)c1.Cn1ccc(C(C)(C)C)n1.Cn1ccc(C(C)(C)C)n1 |
| InChI | InChI=1S/C11H19NO.C9H13F2NO.C9H15NO.C9H15N.C9H13N.C8H12N2O.C8H14N2O.3C8H14N2.C8H13NO.C8H12O.C7H12N2S.2C7H12N2.C7H11NO.C7H11NS.C6H11N3.C6H10N2.3C6H9NO/c1-10(2,3)8-7-9(13-12-8)11(4,5)6;1-8(2,3)7-5-6(12-13-7)9(4,10)11;1-6(2)8-5-9(7(3)4)11-10-8;1-9(2,3)8-5-6-10(4)7-8;1-7(2)9-4-5-10-8(3)6-9;1-5(2)8-9-7(10-11-8)6-3-4-6;1-5(2)7-9-8(6(3)4)11-10-7;2*1-8(2,3)7-5-6-10(4)9-7;1-6(2)8-5-9-10(4)7(8)3;1-4-7-5-8(6(2)3)10-9-7;1-6(2)8-4-5-9-7(8)3;1-5-8-9-6(10-5)7(2,3)4;1-6(2)9-5-7(3)4-8-9;1-7(2,3)6-4-5-8-9-6;1-7(2,3)6-4-9-5-8-6;1-5(2)7-8-4-6(3)9-7;1-5(2)6-4-9(3)8-7-6;1-6(2)8-5-3-4-7-8;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6/h7H,1-6H3;5H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;4-7H,1-3H3;5-6H,3-4H2,1-2H3;5-6H,1-4H3;3*5-6H,1-4H3;5-6H,4H2,1-3H3;4-6H,1-3H3;1-4H3;4-6H,1-3H3;4H,5H2,1-3H3;3*4-5H,1-3H3;3-6H,1-2H3;3*3-5H,1-2H3 |
| InChIKey | IITWZDFWHGEXOQ-UHFFFAOYSA-N |
| XLogP | 47.50 |
| TPSA | 500.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 45 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 215 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3020.38 |
| LogP ≤ 5 | 47.50 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 45 |
Frequently Asked Questions
What is the IUPAC name of 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole?
The IUPAC name of 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole (CID 158711469) is 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole.
What is the SMILES notation for 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole?
The canonical SMILES for 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole is CC(C)(C)C1=CCN=N1.CC(C)(C)c1cc(C(C)(C)C)on1.CC(C)(C)c1cc(C(C)(F)F)no1.CC(C)(C)c1cocn1.CC(C)c1cc(C(C)C)on1.CC(C)c1ccno1.CC(C)c1cn(C)nn1.CC(C)c1cnco1.CC(C)c1nc(C2CC2)no1.CC(C)c1ncco1.CC(C)c1noc(C(C)C)n1.CC(C)n1cccn1.CCc1cc(C(C)C)on1.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)ccn1.Cc1cnc(C(C)C)s1.Cc1cnn(C(C)C)c1.Cc1nnc(C(C)(C)C)s1.Cc1occc1C(C)C.Cn1ccc(C(C)(C)C)c1.Cn1ccc(C(C)(C)C)n1.Cn1ccc(C(C)(C)C)n1.
What is the InChIKey of 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole?
The InChIKey is IITWZDFWHGEXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO.C9H13F2NO.C9H15NO.C9H15N.C9H13N.C8H12N2O.C8H14N2O.3C8H14N2.C8H13NO.C8H12O.C7H12N2S.2C7H12N2.C7H11NO.C7H11NS.C6H11N3.C6H10N2.3C6H9NO/c1-10(2,3)8-7-9(13-12-8)11(4,5)6;1-8(2,3)7-5-6(12-13-7)9(4,10)11;1-6(2)8-5-9(7(3)4)11-10-8;1-9(2,3)8-5-6-10(4)7-8;1-7(2)9-4-5-10-8(3)6-9;1-5(2)8-9-7(10-11-8)6-3-4-6;1-5(2)7-9-8(6(3)4)11-10-7;2*1-8(2,3)7-5-6-10(4)9-7;1-6(2)8-5-9-10(4)7(8)3;1-4-7-5-8(6(2)3)10-9-7;1-6(2)8-4-5-9-7(8)3;1-5-8-9-6(10-5)7(2,3)4;1-6(2)9-5-7(3)4-8-9;1-7(2,3)6-4-5-8-9-6;1-7(2,3)6-4-9-5-8-6;1-5(2)7-8-4-6(3)9-7;1-5(2)6-4-9(3)8-7-6;1-6(2)8-5-3-4-7-8;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6/h7H,1-6H3;5H,1-4H3;5-7H,1-4H3;5-7H,1-4H3;4-7H,1-3H3;5-6H,3-4H2,1-2H3;5-6H,1-4H3;3*5-6H,1-4H3;5-6H,4H2,1-3H3;4-6H,1-3H3;1-4H3;4-6H,1-3H3;4H,5H2,1-3H3;3*4-5H,1-3H3;3-6H,1-2H3;3*3-5H,1-2H3.
What are the key properties of 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole?
5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole has a molecular weight of 3020.38 g/mol, XLogP of 47.50, 19 rotatable bonds, 0 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-(1,1-difluoroethyl)-1,2-oxazole;bis(3-tert-butyl-1-methylpyrazole);3-tert-butyl-1-methylpyrrole;2-tert-butyl-5-methyl-1,3,4-thiadiazole;4-tert-butyl-1,3-oxazole;5-tert-butyl-3H-pyrazole;3-cyclopropyl-5-propan-2-yl-1,2,4-oxadiazole;3,5-ditert-butyl-1,2-oxazole;1,5-dimethyl-4-propan-2-ylpyrazole;3,5-di(propan-2-yl)-1,2,4-oxadiazole;3,5-di(propan-2-yl)-1,2-oxazole;3-ethyl-5-propan-2-yl-1,2-oxazole;2-methyl-3-propan-2-ylfuran;4-methyl-1-propan-2-ylpyrazole;2-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-yl-1,3-thiazole;1-methyl-4-propan-2-yltriazole;2-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;1-propan-2-ylpyrazole is sourced from PubChem (CID 158711469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
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Sources
- PubChem CID 158711469 — identifiers, structure, computed properties (public domain)
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