5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine

C168H293ClF4N24O4S5 — CID 158030848

IUPAC5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)Nc1ccc(C(C)C)cc1C.CC(=O)Nc1nc(C(C)C)cs1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cc1.CC(C)c1cccc(N)c1.CC(C)c1csc(NCCN(C)C)n1.CC(C)c1csc(NCCN2CCCCC2)n1.CC(C)c1csc(NCCN2CCOCC2)n1.COCCNc1nc(C(C)C)cs1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C13H23N3S.C12H21N3OS.C12H17NO.C10H19N3S.C9H10F3N.C9H16N2OS.7C9H13N.C8H10ClN.C8H10FN.C8H12N2OS.16CH4/c1-11(2)12-10-17-13(15-12)14-6-9-16-7-4-3-5-8-16;1-10(2)11-9-17-12(14-11)13-3-4-15-5-7-16-8-6-15;1-8(2)11-5-6-12(9(3)7-11)13-10(4)14;1-8(2)9-7-14-10(12-9)11-5-6-13(3)4;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-6-13-9(11-8)10-4-5-12-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;2*1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-4-3-5-9(10)6-8;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-4-12-8(10-7)9-6(3)11;;;;;;;;;;;;;;;;/h10-11H,3-9H2,1-2H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,13,14);5-8H,1-4H3,(H,13,14);7-8H,5-6H2,1-4H3,(H,11,12);3-6H,1-2H3;6-7H,4-5H2,1-3H3,(H,10,11);5*4-7H,1-3H3;2*3-7H,10H2,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,9,10,11);16*1H4
InChIKeyFHDVSXXPKYJCGO-UHFFFAOYSA-N
MW2985.14 g/mol
LogP51.00
Rot. Bonds34

About 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine

5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine (PubChem CID 158030848) has the molecular formula C168H293ClF4N24O4S5 and a molecular weight of 2985.14 g/mol. Its IUPAC name is 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine
PubChem CID158030848
Molecular FormulaC168H293ClF4N24O4S5
Molecular Weight2985.14 g/mol
Exact Mass2982.17
IUPAC Name5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)Nc1ccc(C(C)C)cc1C.CC(=O)Nc1nc(C(C)C)cs1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cc1.CC(C)c1cccc(N)c1.CC(C)c1csc(NCCN(C)C)n1.CC(C)c1csc(NCCN2CCCCC2)n1.CC(C)c1csc(NCCN2CCOCC2)n1.COCCNc1nc(C(C)C)cs1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1
InChIInChI=1S/C13H23N3S.C12H21N3OS.C12H17NO.C10H19N3S.C9H10F3N.C9H16N2OS.7C9H13N.C8H10ClN.C8H10FN.C8H12N2OS.16CH4/c1-11(2)12-10-17-13(15-12)14-6-9-16-7-4-3-5-8-16;1-10(2)11-9-17-12(14-11)13-3-4-15-5-7-16-8-6-15;1-8(2)11-5-6-12(9(3)7-11)13-10(4)14;1-8(2)9-7-14-10(12-9)11-5-6-13(3)4;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-6-13-9(11-8)10-4-5-12-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;2*1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-4-3-5-9(10)6-8;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-4-12-8(10-7)9-6(3)11;;;;;;;;;;;;;;;;/h10-11H,3-9H2,1-2H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,13,14);5-8H,1-4H3,(H,13,14);7-8H,5-6H2,1-4H3,(H,11,12);3-6H,1-2H3;6-7H,4-5H2,1-3H3,(H,10,11);5*4-7H,1-3H3;2*3-7H,10H2,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,9,10,11);16*1H4
InChIKeyFHDVSXXPKYJCGO-UHFFFAOYSA-N
XLogP51.00
TPSA354.11 Ų
H-Bond Donors8
H-Bond Acceptors31
Rotatable Bonds34
Heavy Atoms206
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002985.14
LogP ≤ 551.00
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine with MolForge

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Related Compounds

N-(2-chloro-6-methylphenyl)-2-[[4-(3-morpholin-4-ylpropylamino)-6-phenyl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-methyl-6-piperazin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide
CID 157289150
1-[5-[4-(2-Aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(4-chlorophenyl)imidazolidin-2-one;1-[5-[4-(2-aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(2,4-difluorophenyl)urea;1-[5-[4-(2-aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-[4-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 157966788
1-[3-[2-Tert-butyl-4-[2-(2-pyrrolidin-1-ylethylamino)-4-pyridinyl]-1,3-thiazol-5-yl]phenyl]-3-(4-methylphenyl)urea;1-(4-chlorophenyl)-3-[2-fluoro-5-[2-(2-morpholin-4-ylethylamino)-4-pyridin-4-yl-1,3-thiazol-5-yl]phenyl]urea;1-(4-chlorophenyl)-3-[3-[2-(2-morpholin-4-ylethylamino)-4-pyridin-4-yl-1,3-thiazol-5-yl]phenyl]urea;1-[2-fluoro-5-[2-(2-morpholin-4-ylethylamino)-4-pyridin-4-yl-1,3-thiazol-5-yl]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 158843002
1-[4-[4-(2-Chloro-4-pyridinyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[4-(6-chloro-3-pyridinyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one;2,2-dimethyl-1-[4-(4-pyridin-3-yl-1,3-thiazol-2-yl)piperazin-1-yl]propan-1-one;2,2-dimethyl-1-[4-[4-[3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]piperazin-1-yl]propan-1-one;1-[4-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[4-(6-fluoro-3-pyridinyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one;1-[4-[4-(2-isocyanophenyl)-1,3-thiazol-2-yl]piperazin-1-yl]-2,2-dimethylpropan-1-one
CID 158918815
N-(2,6-dimethylphenyl)-2-[[4-[4-(4-fluorophenyl)piperazin-1-yl]-6-methyl-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-(3-morpholin-4-ylpropylamino)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[[4-methyl-6-(4-propylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-1,3-thiazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-thiazole-5-carboxamide
CID 162140555
4-(6-chloro-4-iodo-2-pyridinyl)morpholine;(3R)-N-[3-(2-chloro-6-morpholin-4-yl-4-pyridinyl)-4-methylphenyl]-3-ethylpyrrolidine-1-carboxamide;2,6-dichloro-4-iodopyridine;(3R)-3-ethyl-N-[4-methyl-3-[2-morpholin-4-yl-6-(1,3-thiazol-5-yl)-4-pyridinyl]phenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine;sulfane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
CID 164997897
4-[4-chloro-6-(1,3-thiazol-4-yl)-2-pyridinyl]morpholine;(3R)-3-ethyl-N-[4-methyl-3-[2-morpholin-4-yl-6-(1,3-thiazol-4-yl)-4-pyridinyl]phenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
CID 165059393
4-[4-chloro-6-(1,3-thiazol-4-yl)-2-pyridinyl]morpholine;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(1,3-thiazol-4-yl)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
CID 167555546
4-(6-chloro-4-iodo-2-pyridinyl)morpholine;(3S)-N-[3-(2-chloro-6-morpholin-4-yl-4-pyridinyl)-4-methylphenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;2,6-dichloro-4-iodopyridine;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(1,3-thiazol-5-yl)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine;sulfane;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
CID 167579990
(3S)-N-[3-(2-chloro-6-morpholin-4-yl-4-pyridinyl)-4-methylphenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(1,3-thiazol-5-yl)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole
CID 167581471
1-[3-[4-(2-Amino-4-pyridinyl)-2-methyl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(4-methylphenyl)urea;1-[3-[2-tert-butyl-4-[2-(2-hydroxyethylamino)-4-pyridinyl]-1,3-thiazol-5-yl]phenyl]-3-(4-methylphenyl)urea;1-[3-[2-tert-butyl-4-[2-(2-methoxyethylamino)-4-pyridinyl]-1,3-thiazol-5-yl]phenyl]-3-(4-methylphenyl)urea;1-(4-chlorophenyl)-3-[3-(2-piperidin-1-yl-4-pyridin-4-yl-1,3-thiazol-5-yl)phenyl]urea
CID 157722540
1-[3-[4-(2-Aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(2-chloro-4-fluorophenyl)imidazolidin-2-one;1-[3-[4-(2-aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(3-chloro-4-fluorophenyl)imidazolidin-2-one;1-[3-[4-(2-aminopyrimidin-4-yl)-2-morpholin-4-yl-1,3-thiazol-5-yl]-2-fluorophenyl]-3-(4-fluorophenyl)imidazolidin-2-one
CID 158971458

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine (CID 158030848) is 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(=O)Nc1ccc(C(C)C)cc1C.CC(=O)Nc1nc(C(C)C)cs1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cn1.CC(C)c1ccc(F)cn1.CC(C)c1ccc(N)cc1.CC(C)c1cccc(N)c1.CC(C)c1csc(NCCN(C)C)n1.CC(C)c1csc(NCCN2CCCCC2)n1.CC(C)c1csc(NCCN2CCOCC2)n1.COCCNc1nc(C(C)C)cs1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)c1.
What is the InChIKey of 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The InChIKey is FHDVSXXPKYJCGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3S.C12H21N3OS.C12H17NO.C10H19N3S.C9H10F3N.C9H16N2OS.7C9H13N.C8H10ClN.C8H10FN.C8H12N2OS.16CH4/c1-11(2)12-10-17-13(15-12)14-6-9-16-7-4-3-5-8-16;1-10(2)11-9-17-12(14-11)13-3-4-15-5-7-16-8-6-15;1-8(2)11-5-6-12(9(3)7-11)13-10(4)14;1-8(2)9-7-14-10(12-9)11-5-6-13(3)4;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-6-13-9(11-8)10-4-5-12-3;1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-6-8(3)4-5-10-9;2*1-7(2)9-5-4-8(3)6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-4-3-5-9(10)6-8;2*1-6(2)8-4-3-7(9)5-10-8;1-5(2)7-4-12-8(10-7)9-6(3)11;;;;;;;;;;;;;;;;/h10-11H,3-9H2,1-2H3,(H,14,15);9-10H,3-8H2,1-2H3,(H,13,14);5-8H,1-4H3,(H,13,14);7-8H,5-6H2,1-4H3,(H,11,12);3-6H,1-2H3;6-7H,4-5H2,1-3H3,(H,10,11);5*4-7H,1-3H3;2*3-7H,10H2,1-2H3;2*3-6H,1-2H3;4-5H,1-3H3,(H,9,10,11);16*1H4.
What are the key properties of 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine?
5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine has a molecular weight of 2985.14 g/mol, XLogP of 51.00, 34 rotatable bonds, 8 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-propan-2-ylpyridine;N',N'-dimethyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)ethane-1,2-diamine;5-fluoro-2-propan-2-ylpyridine;methane;N-(2-methoxyethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-methyl-4-propan-2-ylphenyl)acetamide;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;bis(5-methyl-2-propan-2-ylpyridine);N-(2-morpholin-4-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;N-(2-piperidin-1-ylethyl)-4-propan-2-yl-1,3-thiazol-2-amine;3-propan-2-ylaniline;4-propan-2-ylaniline;N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide;2-propan-2-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 158030848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).