About 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine
2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine (PubChem CID 159358251) has the molecular formula C208H261N17O5S8
and a molecular weight of 3336.03 g/mol. Its IUPAC name is 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine.
Frequently Asked Questions
What is the IUPAC name of 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine?
The IUPAC name of 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine (CID 159358251) is 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine.
What is the SMILES notation for 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine?
The canonical SMILES for 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine is CC(C)c1ccc2c(c1)CCC2.CC(C)c1ccc2ncsc2c1.CC(C)c1ccc2scnc2c1.CC(C)c1cccc2c1C(=O)N(C)C2.CC(C)c1cccc2c1C(=O)NC2.CC(C)c1cccc2c1CCN(C1CCC1)C2.CC(C)c1cccc2c1CCN2.CC(C)c1cccc2c1CN(C)C2=O.CC(C)c1cccc2c1CN(C1COC1)C2.CC(C)c1cccc2c1CNC2=O.CC(C)c1cccc2nc(N)sc12.CC(C)c1cccc2ncsc12.CC(C)c1cccc2sccc12.CC(C)c1cccc2scnc12.CC(C)c1csc2cnccc12.CCN1CCc2ccc(C(C)C)cc2C1.CCN1Cc2cccc(C(C)C)c2C1.Cc1nc2cccc(C(C)C)c2s1.
What is the InChIKey of 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine?
The InChIKey is LIEUPKHGEUEOLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N.C14H19NO.C14H21N.C13H19N.2C12H15NO.C12H16.2C11H13NO.C11H13NS.C11H15N.C11H12S.C10H12N2S.5C10H11NS/c1-12(2)15-8-3-5-13-11-17(10-9-16(13)15)14-6-4-7-14;1-10(2)13-5-3-4-11-6-15(7-14(11)13)12-8-16-9-12;1-4-15-8-7-12-5-6-13(11(2)3)9-14(12)10-15;1-4-14-8-11-6-5-7-12(10(2)3)13(11)9-14;1-8(2)9-5-4-6-10-11(9)7-13(3)12(10)14;1-8(2)10-6-4-5-9-7-13(3)12(14)11(9)10;1-9(2)11-7-6-10-4-3-5-12(10)8-11;1-7(2)8-4-3-5-9-10(8)6-12-11(9)13;1-7(2)9-5-3-4-8-6-12-11(13)10(8)9;1-7(2)9-5-4-6-10-11(9)13-8(3)12-10;2*1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-6(2)7-4-3-5-8-9(7)13-10(11)12-8;1-7(2)9-6-12-10-5-11-4-3-8(9)10;1-7(2)8-3-4-10-9(5-8)11-6-12-10;1-7(2)8-3-4-9-10(5-8)12-6-11-9;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/h3,5,8,12,14H,4,6-7,9-11H2,1-2H3;3-5,10,12H,6-9H2,1-2H3;5-6,9,11H,4,7-8,10H2,1-3H3;5-7,10H,4,8-9H2,1-3H3;2*4-6,8H,7H2,1-3H3;6-9H,3-5H2,1-2H3;2*3-5,7H,6H2,1-2H3,(H,12,13);4-7H,1-3H3;3-5,8,12H,6-7H2,1-2H3;3-8H,1-2H3;3-6H,1-2H3,(H2,11,12);5*3-7H,1-2H3.
What are the key properties of 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine?
2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine has a molecular weight of 3336.03 g/mol, XLogP of 55.41, 22 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-5-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-ethyl-4-propan-2-yl-1,3-dihydroisoindole;2-ethyl-7-propan-2-yl-3,4-dihydro-1H-isoquinoline;2-methyl-7-propan-2-yl-1,3-benzothiazole;2-methyl-4-propan-2-yl-3H-isoindol-1-one;2-methyl-7-propan-2-yl-3H-isoindol-1-one;2-(oxetan-3-yl)-4-propan-2-yl-1,3-dihydroisoindole;7-propan-2-yl-1,3-benzothiazol-2-amine;4-propan-2-yl-1,3-benzothiazole;5-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1-benzothiophene;5-propan-2-yl-2,3-dihydro-1H-indene;4-propan-2-yl-2,3-dihydro-1H-indole;4-propan-2-yl-2,3-dihydroisoindol-1-one;7-propan-2-yl-2,3-dihydroisoindol-1-one;3-propan-2-ylthieno[2,3-c]pyridine is sourced from PubChem (CID 159358251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).