2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole

C237H372ClF3N44O4 — CID 157354729

IUPAC2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole
SMILESCC(C)c1ccc(Cl)nc1.CC(C)c1cccnc1.CC(C)c1cccnc1C(C)C.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CCO.CC(C)c1cccnc1CO.CC(C)c1ccnn1C.CC(C)c1cn[nH]c1.CC(C)c1cncn1C.CC(C)c1cnn(C)c1.CC(C)c1cnn(CCO)c1.CC(C)c1nncn1C.CCc1ncccc1C(C)C.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)n(C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C)c1C(C)C.Cc1ccncc1C(C)C.Cc1n[nH]c(C)c1C(C)C.Cc1ncccc1C(C)C.Cc1nccnc1C(C)C.Cc1nn(C)c(C)c1C(C)C.Cc1nn(C)c(CCO)c1C(C)C.Cc1nn(C)cc1C(C)C.Cc1nnccc1C(C)C
InChIInChI=1S/C11H17N.C10H18N2O.C10H15NO.3C10H15N.C9H10F3N.C9H16N2.C9H13NO.4C9H13N.C8H10ClN.C8H14N2O.4C8H14N2.2C8H12N2.C8H14N2.C8H11N.3C7H12N2.C6H11N3.C6H10N2/c1-8(2)10-6-5-7-12-11(10)9(3)4;1-7(2)10-8(3)11-12(4)9(10)5-6-13;1-8(2)9-4-3-6-11-10(9)5-7-12;1-7(2)10-8(3)5-6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-10-9(8(2)3)6-5-7-11-10;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)9-7(3)10-11(5)8(9)4;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-6-10-5-4-8(9)3;2*1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-8(9)10-5-7;1-7(2)8-5-9-10(6-8)3-4-11;1-6(2)8-5-10(4)9-7(8)3;1-6(2)8-5-9-10(4)7(8)3;2*1-6(2)8-5-7(3)9-10(8)4;1-6(2)8-7(3)9-4-5-10-8;1-6(2)8-4-5-9-10-7(8)3;1-5(2)8-6(3)9-10-7(8)4;1-7(2)8-4-3-5-9-6-8;1-6(2)7-4-8-5-9(7)3;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-8-9(7)3;1-5(2)6-8-7-4-9(6)3;1-5(2)6-3-7-8-4-6/h5-9H,1-4H3;7,13H,5-6H2,1-4H3;3-4,6,8,12H,5,7H2,1-2H3;2*5-7H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;6H,1-5H3;3-5,7,11H,6H2,1-2H3;4*4-7H,1-3H3;3-6H,1-2H3;5-7,11H,3-4H2,1-2H3;4*5-6H,1-4H3;2*4-6H,1-3H3;5H,1-4H3,(H,9,10);3-7H,1-2H3;3*4-6H,1-3H3;4-5H,1-3H3;3-5H,1-2H3,(H,7,8)
InChIKeyBHYHJSDKPFMSGY-UHFFFAOYSA-N
MW3994.33 g/mol
LogP58.54
Rot. Bonds37

About 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole

2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole (PubChem CID 157354729) has the molecular formula C237H372ClF3N44O4 and a molecular weight of 3994.33 g/mol. Its IUPAC name is 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole.

Molecular Properties

Compound Name2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole
PubChem CID157354729
Molecular FormulaC237H372ClF3N44O4
Molecular Weight3994.33 g/mol
Exact Mass3990.99
IUPAC Name2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole
SMILESCC(C)c1ccc(Cl)nc1.CC(C)c1cccnc1.CC(C)c1cccnc1C(C)C.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CCO.CC(C)c1cccnc1CO.CC(C)c1ccnn1C.CC(C)c1cn[nH]c1.CC(C)c1cncn1C.CC(C)c1cnn(C)c1.CC(C)c1cnn(CCO)c1.CC(C)c1nncn1C.CCc1ncccc1C(C)C.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)n(C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C)c1C(C)C.Cc1ccncc1C(C)C.Cc1n[nH]c(C)c1C(C)C.Cc1ncccc1C(C)C.Cc1nccnc1C(C)C.Cc1nn(C)c(C)c1C(C)C.Cc1nn(C)c(CCO)c1C(C)C.Cc1nn(C)cc1C(C)C.Cc1nnccc1C(C)C
InChIInChI=1S/C11H17N.C10H18N2O.C10H15NO.3C10H15N.C9H10F3N.C9H16N2.C9H13NO.4C9H13N.C8H10ClN.C8H14N2O.4C8H14N2.2C8H12N2.C8H14N2.C8H11N.3C7H12N2.C6H11N3.C6H10N2/c1-8(2)10-6-5-7-12-11(10)9(3)4;1-7(2)10-8(3)11-12(4)9(10)5-6-13;1-8(2)9-4-3-6-11-10(9)5-7-12;1-7(2)10-8(3)5-6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-10-9(8(2)3)6-5-7-11-10;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)9-7(3)10-11(5)8(9)4;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-6-10-5-4-8(9)3;2*1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-8(9)10-5-7;1-7(2)8-5-9-10(6-8)3-4-11;1-6(2)8-5-10(4)9-7(8)3;1-6(2)8-5-9-10(4)7(8)3;2*1-6(2)8-5-7(3)9-10(8)4;1-6(2)8-7(3)9-4-5-10-8;1-6(2)8-4-5-9-10-7(8)3;1-5(2)8-6(3)9-10-7(8)4;1-7(2)8-4-3-5-9-6-8;1-6(2)7-4-8-5-9(7)3;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-8-9(7)3;1-5(2)6-8-7-4-9(6)3;1-5(2)6-3-7-8-4-6/h5-9H,1-4H3;7,13H,5-6H2,1-4H3;3-4,6,8,12H,5,7H2,1-2H3;2*5-7H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;6H,1-5H3;3-5,7,11H,6H2,1-2H3;4*4-7H,1-3H3;3-6H,1-2H3;5-7,11H,3-4H2,1-2H3;4*5-6H,1-4H3;2*4-6H,1-3H3;5H,1-4H3,(H,9,10);3-7H,1-2H3;3*4-6H,1-3H3;4-5H,1-3H3;3-5H,1-2H3,(H,7,8)
InChIKeyBHYHJSDKPFMSGY-UHFFFAOYSA-N
XLogP58.54
TPSA566.32 Ų
H-Bond Donors6
H-Bond Acceptors46
Rotatable Bonds37
Heavy Atoms289
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003994.33
LogP ≤ 558.54
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole with MolForge

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Launch Full Analysis

Related Compounds

(4-fluorophenyl)-[2-[4-[2-[[4-[4-[4-[5-[(4-fluorophenyl)-[1-(4-fluorophenyl)-1-[2-[4-[6-(1H-pyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]ethyl]peroxymethyl]pyrimidin-2-yl]piperazin-1-yl]pyrrolo[2,1-f][1,2,4]triazin-6-yl]pyrazol-1-yl]methyl]-6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]piperazin-1-yl]pyrimidin-5-yl]methanol
CID 123712379
CID 157310252
CID 157310252
(2R,6R)-4-[2-[7-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]-2-methyl-6-(5-methyl-1H-pyrazol-4-yl)morpholine;(2S,6R)-4-[2-[7-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]-2-methyl-6-(5-methyl-1H-pyrazol-4-yl)morpholine;3-[4-[3-fluoro-5-(5-methyl-1H-pyrazol-4-yl)piperidin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine;2-methyl-6-(5-methyl-1H-pyrazol-4-yl)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]morpholine;3-[4-[(2S,3R)-2-methyl-4-(oxetan-3-yl)-3-(1H-pyrazol-4-yl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 157326717
2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyridine;4-methyl-3-propan-2-ylpyridine;4-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole
CID 158924345
[6-[5-chloro-6-[(2R)-2-(4-methylphenyl)propyl]pyridazin-3-yl]-3-(4-methylimidazol-1-yl)-2-pyridinyl]methanol;[6-[4-ethyl-6-[methyl-[(1S)-1-(4-methylphenyl)ethyl]amino]pyridazin-3-yl]-3-(4-methylimidazol-1-yl)-2-pyridinyl]methanol;[6-[5-fluoro-6-[(2R)-2-(4-methylphenyl)propyl]pyridazin-3-yl]-3-(4-methylimidazol-1-yl)-2-pyridinyl]methanol;6-[6-(hydroxymethyl)-5-(4-methylimidazol-1-yl)-2-pyridinyl]-3-[(2R)-2-(4-methylphenyl)propyl]pyridazine-4-carbonitrile;[3-(4-methylimidazol-1-yl)-6-[4-[(2R)-2-(4-methylphenyl)propyl]-5,6,7,8-tetrahydrophthalazin-1-yl]-2-pyridinyl]methanol;[3-(4-methylimidazol-1-yl)-6-[6-[(2R)-2-(4-methylphenyl)propyl]-5-(trifluoromethyl)pyridazin-3-yl]-2-pyridinyl]methanol
CID 159158260
3-[3-chloro-4-methyl-6-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-2-pyridinyl]-2H-pyrazolo[3,4-b]pyridine;3-[6-[(3S)-3-(2-methylpropyl)piperazin-1-yl]-4-(trifluoromethyl)-2-pyridinyl]-2H-pyrazolo[3,4-b]pyridine;molecular hydrogen;3-[6-(3-propylpiperazin-1-yl)-2-pyridinyl]-2H-pyrazolo[3,4-b]pyridine;4-[6-(2H-pyrazolo[3,4-b]pyridin-3-yl)-2-pyridinyl]piperidin-4-ol
CID 159202614
1-(12-chloro-4-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraen-8-yl)-2-[6-(trifluoromethyl)-3-pyridinyl]propan-2-ol;2-(2,8-dimethyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)-1-(1H-pyrazol-4-yl)ethanol;4,12-dimethyl-8-[2-(6-methyl-3-pyridinyl)ethyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraene;1-(4,12-dimethyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraen-8-yl)-2-[6-(trifluoromethyl)-3-pyridinyl]propan-2-ol
CID 159994976
[6-[4-amino-3-(2-methylpropyl)piperidin-1-yl]-2-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidin-4-yl]methanol;3-(3-chloro-4-methyl-6-piperazin-1-yl-2-pyridinyl)-2H-pyrazolo[3,4-b]pyridine;molecular hydrogen;3-[6-piperazin-1-yl-4-(trifluoromethyl)-2-pyridinyl]-2H-pyrazolo[3,4-b]pyridine
CID 160563196
molecular hydrogen;(1S)-1-phenyl-2-[[6-(2H-pyrazolo[3,4-b]pyridin-3-yl)-5-(trifluoromethyl)-2-pyridinyl]amino]ethanol;N-(piperidin-4-ylmethyl)-6-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyridin-2-amine;N-piperidin-4-yl-6-(2H-pyrazolo[3,4-b]pyridin-3-yl)pyridin-2-amine;6-(2H-pyrazolo[3,4-b]pyridin-3-yl)-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 161147695
[5-Chloro-6-[1-[6-[2-[5-[2-[2-[4-[3-chloro-6-[(cyclopropylamino)methyl]-2-pyridinyl]pyrazol-1-yl]-6-cyclopropyl-4-pyridinyl]-5-fluorophenyl]-4-methyl-1,2,4-triazol-3-yl]cyclopropyl]-4-[4-fluoro-2-(4-methyl-1,2,4-triazol-3-yl)phenyl]-2-pyridinyl]pyrazol-4-yl]-2-pyridinyl]methanol
CID 177367848
tris([6-[6-[[(2S)-butan-2-yl]amino]-5-methylpyridazin-3-yl]-3-(4-methylimidazol-1-yl)-2-pyridinyl]methanol);[3-(4-methylimidazol-1-yl)-6-[5-methyl-6-[[(2S)-3-methylbutan-2-yl]amino]pyridazin-3-yl]-2-pyridinyl]methanol;[3-(4-methylimidazol-1-yl)-6-[5-methyl-6-[[(1S)-1-phenylethyl]amino]pyridazin-3-yl]-2-pyridinyl]methanol
CID 157233581
5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;N,N-dimethylpyrrolidin-3-amine;2-methylpropane;N-methyl-N-(1-propan-2-ylpyrrolidin-3-yl)acetamide;1-methyl-2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]imidazole;2-methyl-6-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine;5-methyl-2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine;N-methyl-6-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrimidin-4-amine;2-methyl-4-(1-propan-2-ylpyrrolidin-3-yl)pyrimidine;4-methyl-3-(1-propan-2-ylpyrrolidin-3-yl)-1,2,4-triazole;4-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine;2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrimidine;5-(1-propan-2-ylpyrrolidin-3-yl)-1H-pyrazole;2-[3-(1-propan-2-ylpyrrolidin-3-yl)-1H-pyrazol-5-yl]ethanol;4-(1-propan-2-ylpyrrolidin-3-yl)pyridine;N,N,2-trimethyl-6-(1-propan-2-ylpyrrolidin-3-yl)pyrimidin-4-amine
CID 157389657

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The IUPAC name of 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole (CID 157354729) is 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole.
What is the SMILES notation for 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The canonical SMILES for 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole is CC(C)c1ccc(Cl)nc1.CC(C)c1cccnc1.CC(C)c1cccnc1C(C)C.CC(C)c1cccnc1C(F)(F)F.CC(C)c1cccnc1CCO.CC(C)c1cccnc1CO.CC(C)c1ccnn1C.CC(C)c1cn[nH]c1.CC(C)c1cncn1C.CC(C)c1cnn(C)c1.CC(C)c1cnn(CCO)c1.CC(C)c1nncn1C.CCc1ncccc1C(C)C.Cc1c(C(C)C)cnn1C.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)n(C)n1.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)cn1.Cc1ccnc(C)c1C(C)C.Cc1ccncc1C(C)C.Cc1n[nH]c(C)c1C(C)C.Cc1ncccc1C(C)C.Cc1nccnc1C(C)C.Cc1nn(C)c(C)c1C(C)C.Cc1nn(C)c(CCO)c1C(C)C.Cc1nn(C)cc1C(C)C.Cc1nnccc1C(C)C.
What is the InChIKey of 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole?
The InChIKey is BHYHJSDKPFMSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C10H18N2O.C10H15NO.3C10H15N.C9H10F3N.C9H16N2.C9H13NO.4C9H13N.C8H10ClN.C8H14N2O.4C8H14N2.2C8H12N2.C8H14N2.C8H11N.3C7H12N2.C6H11N3.C6H10N2/c1-8(2)10-6-5-7-12-11(10)9(3)4;1-7(2)10-8(3)11-12(4)9(10)5-6-13;1-8(2)9-4-3-6-11-10(9)5-7-12;1-7(2)10-8(3)5-6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-10-9(8(2)3)6-5-7-11-10;1-6(2)7-4-3-5-13-8(7)9(10,11)12;1-6(2)9-7(3)10-11(5)8(9)4;1-7(2)8-4-3-5-10-9(8)6-11;1-7(2)9-6-10-5-4-8(9)3;2*1-7(2)9-5-4-8(3)10-6-9;1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-3-4-8(9)10-5-7;1-7(2)8-5-9-10(6-8)3-4-11;1-6(2)8-5-10(4)9-7(8)3;1-6(2)8-5-9-10(4)7(8)3;2*1-6(2)8-5-7(3)9-10(8)4;1-6(2)8-7(3)9-4-5-10-8;1-6(2)8-4-5-9-10-7(8)3;1-5(2)8-6(3)9-10-7(8)4;1-7(2)8-4-3-5-9-6-8;1-6(2)7-4-8-5-9(7)3;1-6(2)7-4-8-9(3)5-7;1-6(2)7-4-5-8-9(7)3;1-5(2)6-8-7-4-9(6)3;1-5(2)6-3-7-8-4-6/h5-9H,1-4H3;7,13H,5-6H2,1-4H3;3-4,6,8,12H,5,7H2,1-2H3;2*5-7H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;6H,1-5H3;3-5,7,11H,6H2,1-2H3;4*4-7H,1-3H3;3-6H,1-2H3;5-7,11H,3-4H2,1-2H3;4*5-6H,1-4H3;2*4-6H,1-3H3;5H,1-4H3,(H,9,10);3-7H,1-2H3;3*4-6H,1-3H3;4-5H,1-3H3;3-5H,1-2H3,(H,7,8).
What are the key properties of 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole?
2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole has a molecular weight of 3994.33 g/mol, XLogP of 58.54, 37 rotatable bonds, 6 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-propan-2-ylpyridine;1,3-dimethyl-4-propan-2-ylpyrazole;bis(1,3-dimethyl-5-propan-2-ylpyrazole);1,5-dimethyl-4-propan-2-ylpyrazole;3,5-dimethyl-4-propan-2-yl-1H-pyrazole;2-(1,3-dimethyl-4-propan-2-ylpyrazol-5-yl)ethanol;2,4-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2,3-di(propan-2-yl)pyridine;2-ethyl-3-propan-2-ylpyridine;1-methyl-5-propan-2-ylimidazole;2-methyl-3-propan-2-ylpyrazine;1-methyl-4-propan-2-ylpyrazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-4-propan-2-ylpyridazine;2-methyl-3-propan-2-ylpyridine;bis(2-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;4-methyl-3-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1H-pyrazole;2-(4-propan-2-ylpyrazol-1-yl)ethanol;3-propan-2-ylpyridine;2-(3-propan-2-yl-2-pyridinyl)ethanol;(3-propan-2-yl-2-pyridinyl)methanol;3-propan-2-yl-2-(trifluoromethyl)pyridine;1,3,5-trimethyl-4-propan-2-ylpyrazole is sourced from PubChem (CID 157354729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).