About 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol
3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol (PubChem CID 167590712) has the molecular formula C199H230F3N23O9S
and a molecular weight of 3177.24 g/mol. Its IUPAC name is 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol.
Frequently Asked Questions
What is the IUPAC name of 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol?
The IUPAC name of 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol (CID 167590712) is 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol.
What is the SMILES notation for 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol?
The canonical SMILES for 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol is CC(C)c1c[nH]c2ccccc12.CC(C)c1cc(O)cc2cccnc12.CC(C)c1ccc2nc[nH]c2c1.CC(C)c1ccc2ocnc2c1.CC(C)c1cccc2[nH]ccc12.CC(C)c1cccc2[nH]ccc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2[nH]cnc12.CC(C)c1cccc2cc[nH]c12.CC(C)c1cccc2ncoc12.CC(C)c1cccc2ocnc12.Cc1ccc2ocnc2c1C(C)C.Cc1ccc2onc(C#N)c2c1C(C)C.Cc1ccc2onc(C(F)(F)F)c2c1C(C)C.Cc1ccc2onc(C)c2c1C(C)C.Cc1ccc2onc(C3CC3)c2c1C(C)C.Cc1ccc2snc(C)c2c1C(C)C.
What is the InChIKey of 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol?
The InChIKey is IJYBFOXQCNAPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO.C12H12F3NO.C12H12N2O.C12H15NO.C12H13NO.C12H15NS.C11H13NO.4C11H13N.4C10H12N2.3C10H11NO/c1-8(2)12-9(3)4-7-11-13(12)14(15-16-11)10-5-6-10;1-6(2)9-7(3)4-5-8-10(9)11(16-17-8)12(13,14)15;1-7(2)11-8(3)4-5-10-12(11)9(6-13)14-15-10;1-7(2)11-8(3)5-6-10-12(11)9(4)13-14-10;1-8(2)11-7-10(14)6-9-4-3-5-13-12(9)11;1-7(2)11-8(3)5-6-10-12(11)9(4)13-14-10;1-7(2)10-8(3)4-5-9-11(10)12-6-13-9;2*1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-8(2)10-5-3-4-9-6-7-12-11(9)10;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-7(2)8-3-4-9-10(5-8)12-6-11-9;3*1-7(2)8-4-3-5-9-10(8)12-6-11-9;1-7(2)8-3-4-10-9(5-8)11-6-12-10;1-7(2)8-4-3-5-9-10(8)11-6-12-9;1-7(2)8-4-3-5-9-10(8)12-6-11-9/h4,7-8,10H,5-6H2,1-3H3;4-6H,1-3H3;4-5,7H,1-3H3;5-7H,1-4H3;3-8,14H,1-2H3;5-7H,1-4H3;4-7H,1-3H3;4*3-8,12H,1-2H3;4*3-7H,1-2H3,(H,11,12);3*3-7H,1-2H3.
What are the key properties of 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol?
3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol has a molecular weight of 3177.24 g/mol, XLogP of 58.24, 19 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-methyl-4-propan-2-yl-1,2-benzoxazole;3,5-dimethyl-4-propan-2-yl-1,2-benzothiazole;3,5-dimethyl-4-propan-2-yl-1,2-benzoxazole;5-methyl-4-propan-2-yl-1,3-benzoxazole;5-methyl-4-propan-2-yl-1,2-benzoxazole-3-carbonitrile;5-methyl-4-propan-2-yl-3-(trifluoromethyl)-1,2-benzoxazole;tris(4-propan-2-yl-1H-benzimidazole);6-propan-2-yl-1H-benzimidazole;4-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-1H-indole;bis(4-propan-2-yl-1H-indole);7-propan-2-yl-1H-indole;8-propan-2-ylquinolin-6-ol is sourced from PubChem (CID 167590712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).