2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine

C255H373F6N52O11S3+ — CID 157181702

IUPAC2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine
SMILESCC(C)c1ccc(C(=O)O)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(C2CC2)nc1.CC(C)c1ccc(CO)nc1.CC(C)c1ccc[n+](O)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncn1.CC(C)c1cnc(C(C)C)[nH]1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1cnno1.CC(C)c1cocn1.CC(C)c1conn1.CC(C)c1cscn1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncon1.CCc1ccc(C(C)C)cn1.CCc1ccc(C(F)(F)F)nc1.Cc1ccc(C(C)C)cn1.Cc1ccc(C)nc1.Cc1ccncc1.Cc1cncnc1.Cc1ncc(C(C)C)[nH]1.Cc1ncc(C(C)C)cn1.Cc1ncc(C(C)C)n1C
InChIInChI=1S/C11H15N.C11H17N.C10H15N.C9H10F3N.C9H15N3.C9H16N2.C9H11NO2.C9H13NO.C9H13N.C8H8F3N.C8H14N2.C8H12N2.C8H12NO.2C8H11N.C7H12N2.4C7H10N2.C7H9N.2C6H10N2.3C6H9NO.3C6H9NS.C6H7N.4C5H8N2O.C5H6N2/c1-8(2)10-5-6-11(12-7-10)9-3-4-9;1-8(2)10-5-6-11(9(3)4)12-7-10;1-4-10-6-5-9(7-11-10)8(2)3;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-7(2)8-5-10-9(11-6-8)12(3)4;1-6(2)8-5-10-9(11-8)7(3)4;1-6(2)7-3-4-8(9(11)12)10-5-7;1-7(2)8-3-4-9(6-11)10-5-8;1-7(2)9-5-4-8(3)10-6-9;1-2-6-3-4-7(12-5-6)8(9,10)11;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-4-9-7(3)10-5-8;1-7(2)8-4-3-5-9(10)6-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)7-4-8-6(3)9-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;2*1-6(2)7-8-4-3-5-9-7;1-6-3-4-7(2)8-5-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-6-2-4-7-5-3-6;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-3-8-7-6-5;1-4(2)5-3-6-7-8-5;1-5-2-6-4-7-3-5/h5-9H,3-4H2,1-2H3;5-9H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;5-7H,1-4H3;5-7H,1-4H3,(H,10,11);3-6H,1-2H3,(H,11,12);3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-5H,2H2,1H3;5-6H,1-4H3;4-6H,1-3H3;3-7,10H,1-2H3;2*3-7H,1-2H3;4-5H,1-3H3,(H,8,9);4*3-6H,1-2H3;3-5H,1-2H3;2*3-5H,1-2H3,(H,7,8);6*3-5H,1-2H3;2-5H,1H3;4*3-4H,1-2H3;2-4H,1H3/q;;;;;;;;;;;;+1;;;;;;;;;;;;;;;;;;;;;;
InChIKeyOYVRJTRZZRBIIK-UHFFFAOYSA-N
MW4553.33 g/mol
LogP67.15
Rot. Bonds39

About 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine

2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine (PubChem CID 157181702) has the molecular formula C255H373F6N52O11S3+ and a molecular weight of 4553.33 g/mol. Its IUPAC name is 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine
PubChem CID157181702
Molecular FormulaC255H373F6N52O11S3+
Molecular Weight4553.33 g/mol
Exact Mass4549.93
IUPAC Name2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine
SMILESCC(C)c1ccc(C(=O)O)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(C2CC2)nc1.CC(C)c1ccc(CO)nc1.CC(C)c1ccc[n+](O)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncn1.CC(C)c1cnc(C(C)C)[nH]1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1cnno1.CC(C)c1cocn1.CC(C)c1conn1.CC(C)c1cscn1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncon1.CCc1ccc(C(C)C)cn1.CCc1ccc(C(F)(F)F)nc1.Cc1ccc(C(C)C)cn1.Cc1ccc(C)nc1.Cc1ccncc1.Cc1cncnc1.Cc1ncc(C(C)C)[nH]1.Cc1ncc(C(C)C)cn1.Cc1ncc(C(C)C)n1C
InChIInChI=1S/C11H15N.C11H17N.C10H15N.C9H10F3N.C9H15N3.C9H16N2.C9H11NO2.C9H13NO.C9H13N.C8H8F3N.C8H14N2.C8H12N2.C8H12NO.2C8H11N.C7H12N2.4C7H10N2.C7H9N.2C6H10N2.3C6H9NO.3C6H9NS.C6H7N.4C5H8N2O.C5H6N2/c1-8(2)10-5-6-11(12-7-10)9-3-4-9;1-8(2)10-5-6-11(9(3)4)12-7-10;1-4-10-6-5-9(7-11-10)8(2)3;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-7(2)8-5-10-9(11-6-8)12(3)4;1-6(2)8-5-10-9(11-8)7(3)4;1-6(2)7-3-4-8(9(11)12)10-5-7;1-7(2)8-3-4-9(6-11)10-5-8;1-7(2)9-5-4-8(3)10-6-9;1-2-6-3-4-7(12-5-6)8(9,10)11;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-4-9-7(3)10-5-8;1-7(2)8-4-3-5-9(10)6-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)7-4-8-6(3)9-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;2*1-6(2)7-8-4-3-5-9-7;1-6-3-4-7(2)8-5-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-6-2-4-7-5-3-6;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-3-8-7-6-5;1-4(2)5-3-6-7-8-5;1-5-2-6-4-7-3-5/h5-9H,3-4H2,1-2H3;5-9H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;5-7H,1-4H3;5-7H,1-4H3,(H,10,11);3-6H,1-2H3,(H,11,12);3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-5H,2H2,1H3;5-6H,1-4H3;4-6H,1-3H3;3-7,10H,1-2H3;2*3-7H,1-2H3;4-5H,1-3H3,(H,8,9);4*3-6H,1-2H3;3-5H,1-2H3;2*3-5H,1-2H3,(H,7,8);6*3-5H,1-2H3;2-5H,1H3;4*3-4H,1-2H3;2-4H,1H3/q;;;;;;;;;;;;+1;;;;;;;;;;;;;;;;;;;;;;
InChIKeyOYVRJTRZZRBIIK-UHFFFAOYSA-N
XLogP67.15
TPSA825.00 Ų
H-Bond Donors7
H-Bond Acceptors60
Rotatable Bonds39
Heavy Atoms327
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004553.33
LogP ≤ 567.15
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1060

Analyze 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine with MolForge

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What is the IUPAC name of 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The IUPAC name of 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine (CID 157181702) is 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine is CC(C)c1ccc(C(=O)O)nc1.CC(C)c1ccc(C(C)C)nc1.CC(C)c1ccc(C(F)(F)F)nc1.CC(C)c1ccc(C2CC2)nc1.CC(C)c1ccc(CO)nc1.CC(C)c1ccc[n+](O)c1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncn1.CC(C)c1cnc(C(C)C)[nH]1.CC(C)c1cnc(N(C)C)nc1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1cnno1.CC(C)c1cocn1.CC(C)c1conn1.CC(C)c1cscn1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncon1.CCc1ccc(C(C)C)cn1.CCc1ccc(C(F)(F)F)nc1.Cc1ccc(C(C)C)cn1.Cc1ccc(C)nc1.Cc1ccncc1.Cc1cncnc1.Cc1ncc(C(C)C)[nH]1.Cc1ncc(C(C)C)cn1.Cc1ncc(C(C)C)n1C.
What is the InChIKey of 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine?
The InChIKey is OYVRJTRZZRBIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N.C11H17N.C10H15N.C9H10F3N.C9H15N3.C9H16N2.C9H11NO2.C9H13NO.C9H13N.C8H8F3N.C8H14N2.C8H12N2.C8H12NO.2C8H11N.C7H12N2.4C7H10N2.C7H9N.2C6H10N2.3C6H9NO.3C6H9NS.C6H7N.4C5H8N2O.C5H6N2/c1-8(2)10-5-6-11(12-7-10)9-3-4-9;1-8(2)10-5-6-11(9(3)4)12-7-10;1-4-10-6-5-9(7-11-10)8(2)3;1-6(2)7-3-4-8(13-5-7)9(10,11)12;1-7(2)8-5-10-9(11-6-8)12(3)4;1-6(2)8-5-10-9(11-8)7(3)4;1-6(2)7-3-4-8(9(11)12)10-5-7;1-7(2)8-3-4-9(6-11)10-5-8;1-7(2)9-5-4-8(3)10-6-9;1-2-6-3-4-7(12-5-6)8(9,10)11;1-6(2)8-5-9-7(3)10(8)4;1-6(2)8-4-9-7(3)10-5-8;1-7(2)8-4-3-5-9(10)6-8;1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;1-5(2)7-4-8-6(3)9-7;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;2*1-6(2)7-8-4-3-5-9-7;1-6-3-4-7(2)8-5-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-6-2-4-7-5-3-6;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-3-8-7-6-5;1-4(2)5-3-6-7-8-5;1-5-2-6-4-7-3-5/h5-9H,3-4H2,1-2H3;5-9H,1-4H3;5-8H,4H2,1-3H3;3-6H,1-2H3;5-7H,1-4H3;5-7H,1-4H3,(H,10,11);3-6H,1-2H3,(H,11,12);3-5,7,11H,6H2,1-2H3;4-7H,1-3H3;3-5H,2H2,1H3;5-6H,1-4H3;4-6H,1-3H3;3-7,10H,1-2H3;2*3-7H,1-2H3;4-5H,1-3H3,(H,8,9);4*3-6H,1-2H3;3-5H,1-2H3;2*3-5H,1-2H3,(H,7,8);6*3-5H,1-2H3;2-5H,1H3;4*3-4H,1-2H3;2-4H,1H3/q;;;;;;;;;;;;+1;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine?
2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine has a molecular weight of 4553.33 g/mol, XLogP of 67.15, 39 rotatable bonds, 7 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-propan-2-ylpyridine;1,2-dimethyl-5-propan-2-ylimidazole;N,N-dimethyl-5-propan-2-ylpyrimidin-2-amine;2,5-dimethylpyridine;2,5-di(propan-2-yl)-1H-imidazole;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;5-ethyl-2-(trifluoromethyl)pyridine;1-hydroxy-3-propan-2-ylpyridin-1-ium;2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-ylpyridine;2-methyl-5-propan-2-ylpyrimidine;4-methylpyridine;5-methylpyrimidine;2-propan-2-yl-1H-imidazole;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;4-propan-2-yloxadiazole;5-propan-2-yloxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;bis(2-propan-2-ylpyrimidine);4-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;5-propan-2-yl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 157181702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).