1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene

C226H301Cl3F8N40O2S2 — CID 162281454

IUPAC1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
SMILESCC(C)Cc1cc(C(C)C)n(C)n1.CC(C)c1[nH]nc2ccc(F)cc12.CC(C)c1cc(-c2ccccn2)n[nH]1.CC(C)c1cc(Cl)ccc1Cl.CC(C)c1cc(F)ccc1Cl.CC(C)c1cc2ccccn2n1.CC(C)c1ccc2ccn(C)c2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1cccc2c1ccn2C.CC(C)c1cccc2nnnn12.CC(C)c1ccccc1C(F)(F)F.CC(C)c1cccnc1N.CC(C)c1cnc(-c2ccccc2)[nH]1.CC(C)c1cnccn1.CC(C)c1nc2ccccn2c1F.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CCCn1nc(C)cc1C(C)C.COCc1ccc(C(C)C)cc1.Cc1c(C(C)C)nnn1C.Cc1cc(=O)n2[nH]c(C(C)C)nc2n1.Cc1ccncc1C(C)C.Cc1cnc(N)c(C(C)C)c1.Cc1ncncc1C(C)C
InChIInChI=1S/C12H14N2.2C12H15N.C11H13N3.C11H20N2.C11H16O.C10H11F3.2C10H11FN2.C10H12N2.C10H18N2.C10H11NS.C9H10Cl2.C9H10ClF.C9H12N4O.C9H14N2.C9H13N.C8H9F2N.C8H10N4.2C8H12N2.C7H13N3.C7H10N2.C6H9NS/c1-9(2)11-8-13-12(14-11)10-6-4-3-5-7-10;1-9(2)11-5-4-10-6-7-13(3)12(10)8-11;1-9(2)10-5-4-6-12-11(10)7-8-13(12)3;1-8(2)10-7-11(14-13-10)9-5-3-4-6-12-9;1-8(2)6-10-7-11(9(3)4)13(5)12-10;1-9(2)11-6-4-10(5-7-11)8-12-3;1-7(2)8-5-3-4-6-9(8)10(11,12)13;1-6(2)10-8-5-7(11)3-4-9(8)12-13-10;1-7(2)9-10(11)13-6-4-3-5-8(13)12-9;1-8(2)10-7-9-5-3-4-6-12(9)11-10;1-5-6-12-10(8(2)3)7-9(4)11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-6(2)8-5-7(10)3-4-9(8)11;1-6(2)8-5-7(11)3-4-9(8)10;1-5(2)8-11-9-10-6(3)4-7(14)13(9)12-8;1-6(2)8-4-7(3)5-11-9(8)10;1-7(2)9-6-10-5-4-8(9)3;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8-9-10-11-12(7)8;1-6(2)8-4-9-5-10-7(8)3;1-6(2)7-4-3-5-10-8(7)9;1-5(2)7-6(3)10(4)9-8-7;1-6(2)7-5-8-3-4-9-7;1-5(2)6-7-3-4-8-6/h3-9H,1-2H3,(H,13,14);2*4-9H,1-3H3;3-8H,1-2H3,(H,13,14);7-9H,6H2,1-5H3;4-7,9H,8H2,1-3H3;3-7H,1-2H3;3-6H,1-2H3,(H,12,13);3-7H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;3-7H,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,10,11,12);4-6H,1-3H3,(H2,10,11);4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);5H,1-4H3;3-6H,1-2H3;3-5H,1-2H3
InChIKeyRZDVICRLODEWLW-UHFFFAOYSA-N
MW3932.65 g/mol
LogP61.67
Rot. Bonds32

About 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene

1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene (PubChem CID 162281454) has the molecular formula C226H301Cl3F8N40O2S2 and a molecular weight of 3932.65 g/mol. Its IUPAC name is 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
PubChem CID162281454
Molecular FormulaC226H301Cl3F8N40O2S2
Molecular Weight3932.65 g/mol
Exact Mass3928.31
IUPAC Name1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
SMILESCC(C)Cc1cc(C(C)C)n(C)n1.CC(C)c1[nH]nc2ccc(F)cc12.CC(C)c1cc(-c2ccccn2)n[nH]1.CC(C)c1cc(Cl)ccc1Cl.CC(C)c1cc(F)ccc1Cl.CC(C)c1cc2ccccn2n1.CC(C)c1ccc2ccn(C)c2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1cccc2c1ccn2C.CC(C)c1cccc2nnnn12.CC(C)c1ccccc1C(F)(F)F.CC(C)c1cccnc1N.CC(C)c1cnc(-c2ccccc2)[nH]1.CC(C)c1cnccn1.CC(C)c1nc2ccccn2c1F.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CCCn1nc(C)cc1C(C)C.COCc1ccc(C(C)C)cc1.Cc1c(C(C)C)nnn1C.Cc1cc(=O)n2[nH]c(C(C)C)nc2n1.Cc1ccncc1C(C)C.Cc1cnc(N)c(C(C)C)c1.Cc1ncncc1C(C)C
InChIInChI=1S/C12H14N2.2C12H15N.C11H13N3.C11H20N2.C11H16O.C10H11F3.2C10H11FN2.C10H12N2.C10H18N2.C10H11NS.C9H10Cl2.C9H10ClF.C9H12N4O.C9H14N2.C9H13N.C8H9F2N.C8H10N4.2C8H12N2.C7H13N3.C7H10N2.C6H9NS/c1-9(2)11-8-13-12(14-11)10-6-4-3-5-7-10;1-9(2)11-5-4-10-6-7-13(3)12(10)8-11;1-9(2)10-5-4-6-12-11(10)7-8-13(12)3;1-8(2)10-7-11(14-13-10)9-5-3-4-6-12-9;1-8(2)6-10-7-11(9(3)4)13(5)12-10;1-9(2)11-6-4-10(5-7-11)8-12-3;1-7(2)8-5-3-4-6-9(8)10(11,12)13;1-6(2)10-8-5-7(11)3-4-9(8)12-13-10;1-7(2)9-10(11)13-6-4-3-5-8(13)12-9;1-8(2)10-7-9-5-3-4-6-12(9)11-10;1-5-6-12-10(8(2)3)7-9(4)11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-6(2)8-5-7(10)3-4-9(8)11;1-6(2)8-5-7(11)3-4-9(8)10;1-5(2)8-11-9-10-6(3)4-7(14)13(9)12-8;1-6(2)8-4-7(3)5-11-9(8)10;1-7(2)9-6-10-5-4-8(9)3;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8-9-10-11-12(7)8;1-6(2)8-4-9-5-10-7(8)3;1-6(2)7-4-3-5-10-8(7)9;1-5(2)7-6(3)10(4)9-8-7;1-6(2)7-5-8-3-4-9-7;1-5(2)6-7-3-4-8-6/h3-9H,1-2H3,(H,13,14);2*4-9H,1-3H3;3-8H,1-2H3,(H,13,14);7-9H,6H2,1-5H3;4-7,9H,8H2,1-3H3;3-7H,1-2H3;3-6H,1-2H3,(H,12,13);3-7H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;3-7H,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,10,11,12);4-6H,1-3H3,(H2,10,11);4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);5H,1-4H3;3-6H,1-2H3;3-5H,1-2H3
InChIKeyRZDVICRLODEWLW-UHFFFAOYSA-N
XLogP61.67
TPSA506.04 Ų
H-Bond Donors6
H-Bond Acceptors40
Rotatable Bonds32
Heavy Atoms281
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003932.65
LogP ≤ 561.67
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1040

Analyze 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene with MolForge

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Launch Full Analysis

Related Compounds

3-chloro-2-propan-2-ylthiophene;2,5-dichloro-4-propan-2-ylpyridine;1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;2,4-dimethyl-1-propan-2-ylbenzene;5,7-dimethyl-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyrimidine;2-fluoro-1,3-dimethyl-5-propan-2-ylbenzene;1-fluoro-2-methyl-4-propan-2-ylbenzene;5-fluoro-3-propan-2-yl-2H-indazole;methane;1-methoxy-2-methyl-3-propan-2-ylbenzene;4-methyl-2,5-di(propan-2-yl)pyrimidine;1-methyl-2-propan-2-ylimidazole;5-methyl-3-propan-2-ylpyridin-2-amine;2-methyl-3-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-4-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-yl-1H-indole;2-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;4-propan-2-yl-3-(trifluoromethyl)pyridine
CID 162269176
CID 162270126
CID 162270126
CID 162270999
CID 162270999
4-chloro-1-methyl-2-propan-2-ylbenzene;2-chloro-5-methyl-4-propan-2-ylpyridine;1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;4-fluoro-1-methyl-2-propan-2-ylbenzene;5-fluoro-3-methyl-2-propan-2-ylpyridine;1-(methoxymethyl)-4-propan-2-ylbenzene;5-methyl-7-methylidene-2-propan-2-yl-4H-[1,2,4]triazolo[1,5-a]pyrimidine;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;5-methyl-3-propan-2-yl-2H-indazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-5-propan-2-ylpyrimidine;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 162277779
CID 162280858
CID 162280858
CID 162280861
CID 162280861
1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 162281455
2-chloro-5-methyl-4-propan-2-ylpyridine;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;2,5-dimethyl-3-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;1-fluoro-2-methyl-4-propan-2-ylbenzene;4-fluoro-1-methyl-2-propan-2-ylbenzene;1-(methoxymethyl)-4-propan-2-ylbenzene;4-methyl-2,5-di(propan-2-yl)pyrimidine;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;5-methyl-3-propan-2-yl-2H-indazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-5-propan-2-ylpyrimidine;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-ylindolizine;2-propan-2-ylpyrazine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 162281457
4-chloro-1-methyl-2-propan-2-ylbenzene;2-chloro-5-methyl-4-propan-2-ylpyridine;1-(1,1-difluoroethyl)-2-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;1-fluoro-2-methyl-4-propan-2-ylbenzene;4-fluoro-1-methyl-2-propan-2-ylbenzene;5-fluoro-3-methyl-2-propan-2-ylpyridine;1-(methoxymethyl)-4-propan-2-ylbenzene;4-methyl-2,5-di(propan-2-yl)pyrimidine;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;5-methyl-3-propan-2-yl-2H-indazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-5-propan-2-ylpyrimidine;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-propan-2-ylpyridine;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 162281458
4-chloro-1-methyl-2-propan-2-ylbenzene;2-chloro-5-methyl-4-propan-2-ylpyridine;2,5-dimethyl-3-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;1-fluoro-2-methyl-4-propan-2-ylbenzene;4-fluoro-1-methyl-2-propan-2-ylbenzene;5-fluoro-3-methyl-2-propan-2-ylpyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;4-methyl-2,5-di(propan-2-yl)pyrimidine;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-5-propan-2-ylpyrimidine;2-phenyl-5-propan-2-yl-1H-imidazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 162281459
1,4-dichloro-2-propan-2-ylbenzene;1,5-dimethyl-4-propan-2-yltriazole;4-fluoro-1-methyl-2-propan-2-ylbenzene;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine
CID 162281456

Frequently Asked Questions

What is the IUPAC name of 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene?
The IUPAC name of 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene (CID 162281454) is 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene.
What is the SMILES notation for 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene?
The canonical SMILES for 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene is CC(C)Cc1cc(C(C)C)n(C)n1.CC(C)c1[nH]nc2ccc(F)cc12.CC(C)c1cc(-c2ccccn2)n[nH]1.CC(C)c1cc(Cl)ccc1Cl.CC(C)c1cc(F)ccc1Cl.CC(C)c1cc2ccccn2n1.CC(C)c1ccc2ccn(C)c2c1.CC(C)c1ccc2ncsc2c1.CC(C)c1cccc2c1ccn2C.CC(C)c1cccc2nnnn12.CC(C)c1ccccc1C(F)(F)F.CC(C)c1cccnc1N.CC(C)c1cnc(-c2ccccc2)[nH]1.CC(C)c1cnccn1.CC(C)c1nc2ccccn2c1F.CC(C)c1ncc(F)cc1F.CC(C)c1nccs1.CCCn1nc(C)cc1C(C)C.COCc1ccc(C(C)C)cc1.Cc1c(C(C)C)nnn1C.Cc1cc(=O)n2[nH]c(C(C)C)nc2n1.Cc1ccncc1C(C)C.Cc1cnc(N)c(C(C)C)c1.Cc1ncncc1C(C)C.
What is the InChIKey of 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene?
The InChIKey is RZDVICRLODEWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2.2C12H15N.C11H13N3.C11H20N2.C11H16O.C10H11F3.2C10H11FN2.C10H12N2.C10H18N2.C10H11NS.C9H10Cl2.C9H10ClF.C9H12N4O.C9H14N2.C9H13N.C8H9F2N.C8H10N4.2C8H12N2.C7H13N3.C7H10N2.C6H9NS/c1-9(2)11-8-13-12(14-11)10-6-4-3-5-7-10;1-9(2)11-5-4-10-6-7-13(3)12(10)8-11;1-9(2)10-5-4-6-12-11(10)7-8-13(12)3;1-8(2)10-7-11(14-13-10)9-5-3-4-6-12-9;1-8(2)6-10-7-11(9(3)4)13(5)12-10;1-9(2)11-6-4-10(5-7-11)8-12-3;1-7(2)8-5-3-4-6-9(8)10(11,12)13;1-6(2)10-8-5-7(11)3-4-9(8)12-13-10;1-7(2)9-10(11)13-6-4-3-5-8(13)12-9;1-8(2)10-7-9-5-3-4-6-12(9)11-10;1-5-6-12-10(8(2)3)7-9(4)11-12;1-7(2)8-3-4-9-10(5-8)12-6-11-9;1-6(2)8-5-7(10)3-4-9(8)11;1-6(2)8-5-7(11)3-4-9(8)10;1-5(2)8-11-9-10-6(3)4-7(14)13(9)12-8;1-6(2)8-4-7(3)5-11-9(8)10;1-7(2)9-6-10-5-4-8(9)3;1-5(2)8-7(10)3-6(9)4-11-8;1-6(2)7-4-3-5-8-9-10-11-12(7)8;1-6(2)8-4-9-5-10-7(8)3;1-6(2)7-4-3-5-10-8(7)9;1-5(2)7-6(3)10(4)9-8-7;1-6(2)7-5-8-3-4-9-7;1-5(2)6-7-3-4-8-6/h3-9H,1-2H3,(H,13,14);2*4-9H,1-3H3;3-8H,1-2H3,(H,13,14);7-9H,6H2,1-5H3;4-7,9H,8H2,1-3H3;3-7H,1-2H3;3-6H,1-2H3,(H,12,13);3-7H,1-2H3;3-8H,1-2H3;7-8H,5-6H2,1-4H3;3-7H,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,10,11,12);4-6H,1-3H3,(H2,10,11);4-7H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;3-6H,1-2H3,(H2,9,10);5H,1-4H3;3-6H,1-2H3;3-5H,1-2H3.
What are the key properties of 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene?
1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene has a molecular weight of 3932.65 g/mol, XLogP of 61.67, 32 rotatable bonds, 6 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-4-fluoro-2-propan-2-ylbenzene;1,4-dichloro-2-propan-2-ylbenzene;3,5-difluoro-2-propan-2-ylpyridine;1,5-dimethyl-4-propan-2-yltriazole;3-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine;5-fluoro-3-propan-2-yl-2H-indazole;1-(methoxymethyl)-4-propan-2-ylbenzene;1-methyl-3-(2-methylpropyl)-5-propan-2-ylpyrazole;1-methyl-4-propan-2-ylindole;1-methyl-6-propan-2-ylindole;3-methyl-5-propan-2-yl-1-propylpyrazole;5-methyl-3-propan-2-ylpyridin-2-amine;4-methyl-3-propan-2-ylpyridine;4-methyl-5-propan-2-ylpyrimidine;5-methyl-2-propan-2-yl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one;2-phenyl-5-propan-2-yl-1H-imidazole;6-propan-2-yl-1,3-benzothiazole;2-propan-2-ylpyrazine;2-propan-2-ylpyrazolo[1,5-a]pyridine;2-(5-propan-2-yl-1H-pyrazol-3-yl)pyridine;3-propan-2-ylpyridin-2-amine;5-propan-2-yltetrazolo[1,5-a]pyridine;2-propan-2-yl-1,3-thiazole;1-propan-2-yl-2-(trifluoromethyl)benzene is sourced from PubChem (CID 162281454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).