3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine

C268H422Cl4FN31O2 — CID 161457286

IUPAC3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCCc2cn[nH]c21.CC(C)C1CCc2cn[nH]c2C1.CC(C)c1c(Cl)cncc1Cl.CC(C)c1c(F)cncc1Cl.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cn(C)nc2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nn(C)cc2c1.CC(C)c1cccc2c1cnn2C.CC(C)c1cccc2cccnc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccnc2cc[nH]c12.CC(C)c1ccncc1.COc1cc(C)c(C(C)C)c(C)c1.Cc1cc(=O)[nH]c(C)c1C(C)C.Cc1cc(C)c(C(C)C)c(C)n1.Cc1ccnc(C)c1C(C)C.Cc1cncc(C)c1C(C)C.Cc1cncc(Cl)c1C(C)C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1ncnc(C)c1C(C)C.[C-]#[N+]c1cc(C)c(C(C)C)c(C)c1
InChIInChI=1S/4C12H13N.C12H15N.C12H18O.3C11H14N2.C11H17N.C10H12N2.3C10H16N2.C10H15NO.2C10H15N.C9H12ClN.C9H14N2.C8H9Cl2N.C8H9ClFN.3C8H11N.24CH4/c1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-7-3-5-10-6-4-8-13-12(10)11;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;2*1-8(2)12-9(3)6-11(13-5)7-10(12)4;1-8(2)9-4-5-11-10(6-9)7-13(3)12-11;1-8(2)9-4-5-10-7-13(3)12-11(10)6-9;1-8(2)9-5-4-6-11-10(9)7-12-13(11)3;1-7(2)11-8(3)6-9(4)12-10(11)5;1-7(2)8-3-5-11-9-4-6-12-10(8)9;1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)5-9(12)11-8(10)4;1-7(2)10-8(3)5-11-6-9(10)4;1-7(2)10-8(3)5-6-11-9(10)4;1-6(2)9-7(3)4-11-5-8(9)10;1-6(2)9-7(3)10-5-11-8(9)4;2*1-5(2)8-6(9)3-11-4-7(8)10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;;;;;;;;;;;;;;;;;;;;;;;;/h4*3-9H,1-2H3;6-8H,1-4H3;6-8H,1-5H3;3*4-8H,1-3H3;6-7H,1-5H3;3-7,12H,1-2H3;6-8H,3-5H2,1-2H3,(H,11,12);6-7,9H,3-5H2,1-2H3,(H,11,12);6H,1-5H3;5-6H,1-4H3,(H,11,12);2*5-7H,1-4H3;4-6H,1-3H3;5-6H,1-4H3;2*3-5H,1-2H3;3*3-7H,1-2H3;24*1H4
InChIKeyWBIAXUCHRPUYDI-UHFFFAOYSA-N
MW4271.35 g/mol
LogP83.47
Rot. Bonds25

About 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine

3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine (PubChem CID 161457286) has the molecular formula C268H422Cl4FN31O2 and a molecular weight of 4271.35 g/mol. Its IUPAC name is 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine.

Molecular Properties

Compound Name3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine
PubChem CID161457286
Molecular FormulaC268H422Cl4FN31O2
Molecular Weight4271.35 g/mol
Exact Mass4266.26
IUPAC Name3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCCc2cn[nH]c21.CC(C)C1CCc2cn[nH]c2C1.CC(C)c1c(Cl)cncc1Cl.CC(C)c1c(F)cncc1Cl.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cn(C)nc2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nn(C)cc2c1.CC(C)c1cccc2c1cnn2C.CC(C)c1cccc2cccnc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccnc2cc[nH]c12.CC(C)c1ccncc1.COc1cc(C)c(C(C)C)c(C)c1.Cc1cc(=O)[nH]c(C)c1C(C)C.Cc1cc(C)c(C(C)C)c(C)n1.Cc1ccnc(C)c1C(C)C.Cc1cncc(C)c1C(C)C.Cc1cncc(Cl)c1C(C)C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1ncnc(C)c1C(C)C.[C-]#[N+]c1cc(C)c(C(C)C)c(C)c1
InChIInChI=1S/4C12H13N.C12H15N.C12H18O.3C11H14N2.C11H17N.C10H12N2.3C10H16N2.C10H15NO.2C10H15N.C9H12ClN.C9H14N2.C8H9Cl2N.C8H9ClFN.3C8H11N.24CH4/c1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-7-3-5-10-6-4-8-13-12(10)11;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;2*1-8(2)12-9(3)6-11(13-5)7-10(12)4;1-8(2)9-4-5-11-10(6-9)7-13(3)12-11;1-8(2)9-4-5-10-7-13(3)12-11(10)6-9;1-8(2)9-5-4-6-11-10(9)7-12-13(11)3;1-7(2)11-8(3)6-9(4)12-10(11)5;1-7(2)8-3-5-11-9-4-6-12-10(8)9;1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)5-9(12)11-8(10)4;1-7(2)10-8(3)5-11-6-9(10)4;1-7(2)10-8(3)5-6-11-9(10)4;1-6(2)9-7(3)4-11-5-8(9)10;1-6(2)9-7(3)10-5-11-8(9)4;2*1-5(2)8-6(9)3-11-4-7(8)10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;;;;;;;;;;;;;;;;;;;;;;;;/h4*3-9H,1-2H3;6-8H,1-4H3;6-8H,1-5H3;3*4-8H,1-3H3;6-7H,1-5H3;3-7,12H,1-2H3;6-8H,3-5H2,1-2H3,(H,11,12);6-7,9H,3-5H2,1-2H3,(H,11,12);6H,1-5H3;5-6H,1-4H3,(H,11,12);2*5-7H,1-4H3;4-6H,1-3H3;5-6H,1-4H3;2*3-5H,1-2H3;3*3-7H,1-2H3;24*1H4
InChIKeyWBIAXUCHRPUYDI-UHFFFAOYSA-N
XLogP83.47
TPSA405.08 Ų
H-Bond Donors4
H-Bond Acceptors28
Rotatable Bonds25
Heavy Atoms306
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004271.35
LogP ≤ 583.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1028

Analyze 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine with MolForge

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Launch Full Analysis

Related Compounds

1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(1-methylpyrazol-3-yl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(1-methylpyrazol-4-yl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(1H-pyrazol-5-yl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(2H-pyrrol-4-yl)indole;1-butyl-5-[[4-[(2,3-dimethylimidazol-4-yl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indole
CID 159343248
1H-benzimidazole;1-(2-chlorophenyl)pyrazole;5-(1,1-difluoroethyl)-1-methylpyrazole;5-(1,1-difluoroethyl)-1H-pyrazole;1,5-dimethylimidazole;1-(3,4-dimethylphenyl)pyrazole;3,5-dimethylpyridine;1-(2-fluorophenyl)pyrazole;1-(3-fluorophenyl)pyrazole;2-methoxypyridine;3-methoxypyridine;6-methylimidazo[1,2-a]pyridine;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(4-methylphenyl)pyrazole;1,6-naphthyridine;1-propylpyrazole;quinoline;5,6,7,8-tetrahydro-1,6-naphthyridine;2-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 159644367
2-chloro-1-methoxy-3-propan-2-ylbenzene;2-chloro-5-propan-2-ylphenol;1,3-dimethyl-5-propan-2-ylbenzene;4,5-di(propan-2-yl)-1H-pyrazole;2-fluoro-4-methyl-1-propan-2-ylbenzene;1-fluoro-2-propan-2-ylbenzene;2-fluoro-3-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;1-methoxy-4-methyl-2-propan-2-ylbenzene;4-methoxy-2-methyl-1-propan-2-ylbenzene;1-methyl-2-propan-2-ylimidazole;1-methyl-7-propan-2-ylindole;2-methyl-5-propan-2-ylphenol;2-methyl-6-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;4-phenyl-2-propan-2-ylpyridine;2-propan-2-ylbenzonitrile;2-propan-2-yl-1H-indole;1-(3-propan-2-ylphenyl)ethanone;3-(2-propan-2-ylphenyl)pyridine;5-propan-2-ylpyridine-2-carbonitrile;2-propan-2-ylpyrimidine;7-propan-2-ylquinoline;4-propan-2-yl-3-(trifluoromethyl)pyridine
CID 160281062
1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(1-methylpyrazol-4-yl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(1H-pyrazol-5-yl)indole;1-butyl-5-[[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methyl]-3-(2H-pyrrol-4-yl)indole;1-butyl-5-[[4-[(2,3-dimethylimidazol-4-yl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indole;1-butyl-5-[[4-[(2-methyl-1H-imidazol-5-yl)methyl]piperazin-1-yl]methyl]-3-[4-(trifluoromethoxy)phenyl]indole
CID 160450569
2-(5-methoxy-3-pyridinyl)-4-propan-2-ylpyridine;1-methyl-5-(6-propan-2-ylpyrazin-2-yl)indazole;1-methyl-5-(4-propan-2-yl-2-pyridinyl)indazole;1-methyl-5-(5-propan-2-yl-3-pyridinyl)indazole;1-methyl-6-(4-propan-2-yl-2-pyridinyl)indazole;1-methyl-6-(4-propan-2-yl-2-pyridinyl)pyrazolo[4,5-b]pyridine;1-methyl-5-(4-propan-2-ylpyrimidin-2-yl)indazole;1-methyl-5-(6-propan-2-ylpyrimidin-4-yl)indazole;5-(4-propan-2-yl-2-pyridinyl)-1H-indazole;5-(4-propan-2-yl-2-pyridinyl)-1H-pyrimidin-2-one;4-propan-2-yl-2-[3-(4H-triazol-5-yl)phenyl]pyridine
CID 157235746
N-[2-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]-1H-indazol-3-amine;2-(4-chlorophenyl)-7-N-ethyl-4-N-(5-methyl-1H-pyrazol-3-yl)quinazoline-4,7-diamine;2-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)-7-pyrrol-1-ylquinazolin-4-amine;2-(4-chlorophenyl)-N-(5-methyl-1H-pyrazol-3-yl)-5,6,7,8-tetrahydroquinazolin-4-amine;2-(3-methoxyphenyl)-7-methyl-N-(5-methyl-1H-pyrazol-3-yl)quinazolin-4-amine
CID 157290609
3-chloro-5-fluoro-4-propan-2-ylpyridine;1-cyclopropyl-3-propan-2-ylbenzene;1-cyclopropyl-4-propan-2-ylbenzene;3,5-dichloro-4-propan-2-ylpyridine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;4-(2-propan-2-ylphenyl)morpholine;2-(2-propan-2-ylphenyl)pyridine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine
CID 157301922
N-[5-chloro-2-[[2-fluoro-5-methyl-4-(4-propanoylphenyl)phenyl]methyl]pyrimidin-4-yl]-N-quinolin-3-ylacetamide;1-[4-[4-[[5-chloro-4-(2H-indazol-3-ylmethyl)pyrimidin-2-yl]methyl]-5-fluoro-2-methylphenyl]phenyl]propan-1-one;4-[5-methoxy-2-methyl-4-[[5-methyl-4-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]amino]phenyl]-N-methylbenzamide
CID 157392376
1-[4-[6-chloro-2-cyclopenta-1,3-dien-1-yl-8-fluoro-7-(5-methyl-1H-indazol-4-yl)quinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[6-chloro-7-[5-(difluoromethyl)-2-fluorophenyl]-8-fluoroquinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[6-chloro-7-(2,4-difluorophenyl)-8-methoxyquinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one;(E)-1-[4-[6-chloro-8-fluoro-7-(5-methyl-1H-indazol-4-yl)quinazolin-4-yl]piperazin-1-yl]pent-2-en-1-one;1-[4-[6-chloro-2-(methylamino)-7-(5-methyl-1H-indazol-4-yl)quinazolin-4-yl]piperazin-1-yl]prop-2-en-1-one
CID 157439999
4-[3-(4-chloro-1H-benzimidazol-2-yl)-1H-indazol-5-yl]isoquinoline;4-[3-(4-chloro-1H-benzimidazol-2-yl)-1-[(4-methoxyphenyl)methyl]indazol-5-yl]isoquinoline
CID 157494878
6-chloro-4-[3-(cyanomethyl)-4-prop-2-enoylpiperazin-1-yl]-7-(3,5-dimethyl-2H-indazol-4-yl)-8-fluoroquinoline-3-carbonitrile;6-chloro-2-[3-(dimethylamino)propoxy]-7-(1,6-dimethylindazol-7-yl)-8-fluoro-4-(4-prop-2-enoylpiperazin-1-yl)quinoline-3-carbonitrile;1-[4-[6-chloro-7-(1,6-dimethylindazol-7-yl)-8-fluoro-2-methylquinolin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[6-chloro-7-(3,5-dimethyl-2H-indazol-4-yl)-8-fluoro-2-methylquinolin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[6-chloro-7-(3,5-dimethyl-2H-indazol-4-yl)-8-fluoroquinazolin-4-yl]-2-ethylpiperazin-1-yl]prop-2-en-1-one
CID 157501785
6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-4-methoxyquinoline;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-imidazol-2-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-4-methoxyquinoline;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-1,2,4-triazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(3-chlorophenyl)-3-pyridinyl]-4-methoxyquinoline
CID 157690165

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine?
The IUPAC name of 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine (CID 161457286) is 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine.
What is the SMILES notation for 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine?
The canonical SMILES for 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1CCCc2cn[nH]c21.CC(C)C1CCc2cn[nH]c2C1.CC(C)c1c(Cl)cncc1Cl.CC(C)c1c(F)cncc1Cl.CC(C)c1ccc2cccnc2c1.CC(C)c1ccc2cn(C)nc2c1.CC(C)c1ccc2ncccc2c1.CC(C)c1ccc2nn(C)cc2c1.CC(C)c1cccc2c1cnn2C.CC(C)c1cccc2cccnc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccnc2cc[nH]c12.CC(C)c1ccncc1.COc1cc(C)c(C(C)C)c(C)c1.Cc1cc(=O)[nH]c(C)c1C(C)C.Cc1cc(C)c(C(C)C)c(C)n1.Cc1ccnc(C)c1C(C)C.Cc1cncc(C)c1C(C)C.Cc1cncc(Cl)c1C(C)C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1ncnc(C)c1C(C)C.[C-]#[N+]c1cc(C)c(C(C)C)c(C)c1.
What is the InChIKey of 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine?
The InChIKey is WBIAXUCHRPUYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C12H13N.C12H15N.C12H18O.3C11H14N2.C11H17N.C10H12N2.3C10H16N2.C10H15NO.2C10H15N.C9H12ClN.C9H14N2.C8H9Cl2N.C8H9ClFN.3C8H11N.24CH4/c1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-7-3-5-10-6-4-8-13-12(10)11;1-9(2)10-5-6-12-11(8-10)4-3-7-13-12;1-9(2)11-6-5-10-4-3-7-13-12(10)8-11;2*1-8(2)12-9(3)6-11(13-5)7-10(12)4;1-8(2)9-4-5-11-10(6-9)7-13(3)12-11;1-8(2)9-4-5-10-7-13(3)12-11(10)6-9;1-8(2)9-5-4-6-11-10(9)7-12-13(11)3;1-7(2)11-8(3)6-9(4)12-10(11)5;1-7(2)8-3-5-11-9-4-6-12-10(8)9;1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)9-5-3-4-8-6-11-12-10(8)9;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)5-9(12)11-8(10)4;1-7(2)10-8(3)5-11-6-9(10)4;1-7(2)10-8(3)5-6-11-9(10)4;1-6(2)9-7(3)4-11-5-8(9)10;1-6(2)9-7(3)10-5-11-8(9)4;2*1-5(2)8-6(9)3-11-4-7(8)10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;;;;;;;;;;;;;;;;;;;;;;;;/h4*3-9H,1-2H3;6-8H,1-4H3;6-8H,1-5H3;3*4-8H,1-3H3;6-7H,1-5H3;3-7,12H,1-2H3;6-8H,3-5H2,1-2H3,(H,11,12);6-7,9H,3-5H2,1-2H3,(H,11,12);6H,1-5H3;5-6H,1-4H3,(H,11,12);2*5-7H,1-4H3;4-6H,1-3H3;5-6H,1-4H3;2*3-5H,1-2H3;3*3-7H,1-2H3;24*1H4.
What are the key properties of 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine?
3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine has a molecular weight of 4271.35 g/mol, XLogP of 83.47, 25 rotatable bonds, 4 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-fluoro-4-propan-2-ylpyridine;3-chloro-5-methyl-4-propan-2-ylpyridine;3,5-dichloro-4-propan-2-ylpyridine;2,4-dimethyl-3-propan-2-ylpyridine;3,5-dimethyl-4-propan-2-ylpyridine;4,6-dimethyl-5-propan-2-yl-1H-pyridin-2-one;4,6-dimethyl-5-propan-2-ylpyrimidine;5-isocyano-1,3-dimethyl-2-propan-2-ylbenzene;methane;5-methoxy-1,3-dimethyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylindazole;2-methyl-5-propan-2-ylindazole;2-methyl-6-propan-2-ylindazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;7-propan-2-yl-1H-pyrrolo[3,2-b]pyridine;5-propan-2-ylquinoline;6-propan-2-ylquinoline;7-propan-2-ylquinoline;8-propan-2-ylquinoline;6-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;7-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;2,4,6-trimethyl-3-propan-2-ylpyridine;2,4,6-trimethyl-5-propan-2-ylpyrimidine is sourced from PubChem (CID 161457286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).