5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine

C196H236F8N24O2S7 — CID 161220445

IUPAC5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESC.C.C.C.C=C1Cc2ccc(C(C)C)cc2O1.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.CC(C)c1cnc2c(c1)C=CC2.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F
InChIInChI=1S/C12H14O.C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.C11H13N.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NO.C10H11NS.4CH4/c2*1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-8(2)10-6-9-4-3-5-11(9)12-7-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;2*1-7(2)8-3-4-9-10(5-8)12-6-11-9;;;;/h2*4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3-4,6-8H,5H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;2*3-7H,1-2H3;4*1H4
InChIKeyUXKVDHQYYROMSU-UHFFFAOYSA-N
MW3336.66 g/mol
LogP58.95
Rot. Bonds18

About 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine

5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine (PubChem CID 161220445) has the molecular formula C196H236F8N24O2S7 and a molecular weight of 3336.66 g/mol. Its IUPAC name is 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine
PubChem CID161220445
Molecular FormulaC196H236F8N24O2S7
Molecular Weight3336.66 g/mol
Exact Mass3333.70
IUPAC Name5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESC.C.C.C.C=C1Cc2ccc(C(C)C)cc2O1.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.CC(C)c1cnc2c(c1)C=CC2.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F
InChIInChI=1S/C12H14O.C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.C11H13N.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NO.C10H11NS.4CH4/c2*1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-8(2)10-6-9-4-3-5-11(9)12-7-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;2*1-7(2)8-3-4-9-10(5-8)12-6-11-9;;;;/h2*4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3-4,6-8H,5H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;2*3-7H,1-2H3;4*1H4
InChIKeyUXKVDHQYYROMSU-UHFFFAOYSA-N
XLogP58.95
TPSA263.89 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds18
Heavy Atoms237
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003336.66
LogP ≤ 558.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Analyze 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine with MolForge

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Related Compounds

3-(1,3-benzothiazol-2-yl)-7-(diethylamino)-4H-chromen-4-id-2-one;2-(2,4-difluorobenzene-6-id-1-yl)quinoline;6-(4-fluorobenzene-6-id-1-yl)phenanthridine;2-(2-fluorobenzene-6-id-1-yl)quinoline;5-fluoro-1-phenylisoquinoline;decakis(iridium);2-(2H-naphthalen-2-id-1-yl)pyridine;1-phenylisoquinoline;5-phenyl-2-phenyl-1,3-oxazole;2-(3H-thiophen-3-id-2-yl)pyridine;1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazole
CID 158451142
1,3-Benzothiazol-2-yl-(4,5-dimethylfuran-3-yl)-dimethylsilane;dimethyl-(7-methyl-1,3-benzothiazol-2-yl)-(5-methylfuran-3-yl)silane;dimethyl-thiophen-3-yl-[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]silane;ethyl-methyl-(5-methylthiophen-3-yl)-(6-phenyl-1,3-benzoxazol-2-yl)silane;(5-ethylthiophen-3-yl)-dimethyl-[6-(4-propan-2-ylphenyl)-1,3-benzoxazol-2-yl]silane;furan-3-yl-dimethyl-(6-methyl-1,3-benzothiazol-2-yl)silane;methyl-(5-methyl-1,3-benzothiazol-2-yl)-(5-methylfuran-3-yl)-pyrrol-1-ylsilane;methyl-(5-methyl-1,3-benzothiazol-2-yl)-(5-methylthiophen-3-yl)-phenylsilane
CID 159110073
1-tert-butyl-4-propan-2-ylpyrazole;1,2-difluoro-4-propan-2-ylbenzene;2,2-difluoro-5-propan-2-yl-1,3-benzodioxole;1,2-dimethoxy-4-propan-2-ylbenzene;2,3-dimethoxy-5-propan-2-ylpyridine;2-ethoxy-5-propan-2-ylpyridine;1-(methoxymethyl)-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-benzothiazole;2-methyl-5-propan-2-yl-1,3-benzoxazole;2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-ylthiophene;6-propan-2-yl-1,3-benzothiazole;4-propan-2-ylpyridine;4-propan-2-yl-2H-pyrrole;5-propan-2-yl-2-(2,2,2-trifluoroethoxy)pyridine
CID 159144512
4-Dibenzofuran-3-yl-5-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridine;4-dibenzofuran-3-yl-5-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-dibenzothiophen-3-yl-5-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridine;4-dibenzothiophen-3-yl-5-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;octakis(methyl(diphenyl)phosphanium);5-methyl-2-(5-methylpyrazol-2-id-3-yl)-4-(4-phenylphenyl)pyridine;2-[5-methyl-2-(5-methylpyrazol-2-id-3-yl)-4-pyridinyl]-1,3-thiazole;5-methyl-4-(4-phenylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-[5-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-4-pyridinyl]-1,3-thiazole;tetrakis(osmium(2+))
CID 159514987
1,3-Benzothiazol-2-yl-(4,5-dimethylfuran-3-yl)-dimethylsilane;dimethyl-(7-methyl-1,3-benzothiazol-2-yl)-(5-methylfuran-3-yl)silane;dimethyl-thiophen-3-yl-[6-(trifluoromethyl)-1,3-benzoxazol-2-yl]silane;ethyl-methyl-(5-methylthiophen-3-yl)-(6-phenyl-1,3-benzoxazol-2-yl)silane;(5-ethylthiophen-3-yl)-dimethyl-(6-propan-2-yl-1,3-benzoxazol-2-yl)silane;furan-3-yl-dimethyl-(6-methyl-1,3-benzothiazol-2-yl)silane;methyl-(5-methyl-1,3-benzothiazol-2-yl)-(5-methylfuran-3-yl)-pyrrol-1-ylsilane;methyl-(5-methyl-1,3-benzothiazol-2-yl)-(5-methylthiophen-3-yl)-phenylsilane
CID 160103034
2-[3,4-Bis(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);4,5-dimethyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-1,3-oxazole;hexakis(iridium);2-methyl-5-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-1,3,4-oxadiazole;2-phenyl-1,3-benzothiazole;2-phenylpyridine;4-pyridin-2-ylbenzene-5-ide-1-carbonitrile;2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-1,3-benzoxazole;bis(2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine)
CID 160363464
1-(9,9-dimethyl-3H-fluoren-3-id-2-yl)pyrazole;tris(4-hydroxypent-3-en-2-one);hexakis(iridium);2-(2H-naphthalen-2-id-1-yl)-1,3-benzothiazole;2-(3-phenylbenzene-6-id-1-yl)pyridine;2-phenyl-1,3-benzoxazole;2-phenylpyridine;platinum;2-(3H-thiophen-3-id-2-yl)pyridine;2-[4-(trifluoromethyl)benzene-6-id-1-yl]pyridine
CID 162126941
5-tert-butyl-1,3-benzothiazole;7-tert-butyl-1,3-benzothiazole;6-tert-butyl-1,3-benzoxazole;6-tert-butyl-3H-indole;7-tert-butyl-2-(trifluoromethyl)-3H-indole;2-propan-2-yl-1,3-benzothiazole;4-propan-2-yl-1,3-benzothiazole;2-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1,3-benzoxazole
CID 167638320
6-[2-[5-[3-[5-(1,3-Benzothiazol-2-yl)-3-pyridinyl]-5-methylphenyl]-3-pyridinyl]-1,3-benzothiazol-6-yl]-2-[5-[3-[5-(1,3-benzoxazol-2-yl)-3-pyridinyl]-5-methylphenyl]-3-pyridinyl]-1,3-benzoxazole
CID 123812009
2,5-Dimethyl-1-benzofuran;2,6-dimethyl-1,3-benzothiazole;1,4-dimethylcyclohexane;2,5-dimethyl-1,3-dioxane;2,5-dimethylfuran;1,4-dimethylnaphthalene;1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;2,5-dimethyl-1,3,4-oxadiazole;2,5-dimethyl-1,3-oxazole;bis(3,6-dimethylpyridazine);2,5-dimethylpyridine;1,5-dimethyl-1,2,3,4-tetrahydronaphthalene;2,5-dimethyl-1,3,4-thiadiazole;2,5-dimethyl-1,3-thiazole;2,5-dimethylthiophene;methane;1-methyl-4-(4-methylphenyl)benzene;5-methyl-2-(4-methylphenyl)pyridine;bis(1,4-xylene)
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2,4-Dimethyl-7-(4-methylphenyl)-3a,7a-dihydro-1,3-benzoxazole;ethane;2-methyl-6-(4-methylphenyl)-1,3-benzoxazole;2-methyl-5-(4-methylphenyl)furan;3-methyl-1-(4-methylphenyl)pyrazole;2-methyl-5-(4-methylphenyl)pyrimidine;5-methyl-2-(4-methylphenyl)pyrimidine;4-methyl-2-(4-methylphenyl)-1,3-thiazole;5-methyl-2-(4-methylphenyl)-1,3-thiazole;2-methyl-5-(4-methylphenyl)thiophene;2,3,6-trimethyl-5-(4-methylphenyl)thieno[3,2-b]thiophene
CID 157136221
cumene;1-methyl-3-propan-2-ylbenzene;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-ylaniline;4-propan-2-ylaniline;2-propan-2-yl-1,3-benzothiazole;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-1,3-benzoxazole;7-propan-2-yl-3H-indole;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;3-propan-2-ylpyridin-2-amine;4-propan-2-ylpyridin-2-amine;5-propan-2-ylpyridin-2-amine;6-propan-2-ylpyridin-2-amine;2-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1,3-thiazol-2-amine;bis(2-propan-2-yl-1,3-thiazole);4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole
CID 157171081

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The IUPAC name of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine (CID 161220445) is 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine is C.C.C.C.C=C1Cc2ccc(C(C)C)cc2O1.C=C1Cc2ccc(C(C)C)cc2S1.CC(C)c1cc(F)c2ncsc2c1.CC(C)c1cc2ccnn2cc1F.CC(C)c1cc2scnc2cc1F.CC(C)c1ccc2ncoc2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1ccn2ncc(F)c2c1.CC(C)c1ccn2nccc2c1.CC(C)c1ccn2nccc2c1F.CC(C)c1cnc2c(c1)C=CC2.Cc1cc2c(F)c(C(C)C)ccn2n1.Cc1cn2nccc2cc1C(C)C.Cc1cnn2ccc(C(C)C)cc12.Cc1nc2cc(F)c(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nc2ccc(C(C)C)cc2s1.Cc1nn2ccc(C(C)C)cc2c1F.
What is the InChIKey of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine?
The InChIKey is UXKVDHQYYROMSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O.C12H14S.2C11H13FN2.C11H12FNS.2C11H14N2.2C11H13NS.C11H13N.3C10H11FN2.2C10H10FNS.C10H12N2.C10H11NO.C10H11NS.4CH4/c2*1-8(2)10-4-5-11-6-9(3)13-12(11)7-10;1-7(2)9-4-5-14-10(6-9)11(12)8(3)13-14;1-7(2)9-4-5-14-10(11(9)12)6-8(3)13-14;1-6(2)8-4-11-10(5-9(8)12)13-7(3)14-11;1-8(2)11-6-10-4-5-12-13(10)7-9(11)3;1-8(2)10-4-5-13-11(6-10)9(3)7-12-13;2*1-7(2)9-4-5-10-11(6-9)13-8(3)12-10;1-8(2)10-6-9-4-3-5-11(9)12-7-10;1-7(2)8-4-6-13-9(10(8)11)3-5-12-13;1-7(2)9-5-8-3-4-12-13(8)6-10(9)11;1-7(2)8-3-4-13-10(5-8)9(11)6-12-13;1-6(2)7-3-10-9(4-8(7)11)12-5-13-10;1-6(2)7-3-8(11)10-9(4-7)13-5-12-10;1-8(2)9-4-6-12-10(7-9)3-5-11-12;2*1-7(2)8-3-4-9-10(5-8)12-6-11-9;;;;/h2*4-5,7-8H,3,6H2,1-2H3;2*4-7H,1-3H3;4-6H,1-3H3;2*4-8H,1-3H3;2*4-7H,1-3H3;3-4,6-8H,5H2,1-2H3;3*3-7H,1-2H3;2*3-6H,1-2H3;3-8H,1-2H3;2*3-7H,1-2H3;4*1H4.
What are the key properties of 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine?
5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine has a molecular weight of 3336.66 g/mol, XLogP of 58.95, 18 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-6-propan-2-yl-1,3-benzothiazole;3-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-6-propan-2-yl-1,3-benzothiazole;5-fluoro-6-propan-2-yl-1,3-benzothiazole;3-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;4-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-fluoro-5-propan-2-ylpyrazolo[1,5-a]pyridine;methane;2-methylidene-6-propan-2-yl-3H-1-benzofuran;2-methylidene-6-propan-2-yl-3H-1-benzothiophene;bis(2-methyl-6-propan-2-yl-1,3-benzothiazole);3-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-methyl-5-propan-2-ylpyrazolo[1,5-a]pyridine;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;3-propan-2-yl-7H-cyclopenta[b]pyridine;5-propan-2-ylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 161220445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).