5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole

C186H252ClF3N50O15S — CID 159929164

IUPAC5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole
SMILESCCCc1cn(C)c(C)n1.CCCc1cnc(C)[nH]1.CCOc1cccc(C)n1.CCOc1ncccc1C.CCc1ncccc1C.CCn1cccc(C)c1=O.CNC(=O)Cn1ccnc1C.COCc1cc(C)[nH]n1.COCc1cnc(C)n1C.COc1ccnnc1C.COc1ncc(Cl)cc1C.Cc1cc(COc2ncccc2C)on1.Cc1cccn(CC#N)c1=O.Cc1cccnc1-c1cnn(C)c1.Cc1cccnc1OC(C)C.Cc1cccnc1OCc1cscn1.Cc1cncnc1C.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)[nH]1.Cc1ncccn1.Cc1nccn1CC#N.Cc1nccn1CC(=O)N(C)C.Cn1cc(-c2ncco2)cn1.Cn1nccc1C(F)(F)F.[C-]#[N+]Cc1cc(C)[nH]n1
InChIInChI=1S/C11H12N2O2.C10H11N3.C10H10N2OS.C9H13NO.C8H13N3O.C8H8N2O.2C8H14N2.3C8H11NO.C8H11N.C7H8ClNO.C7H7N3O.C7H11N3O.C7H12N2O.2C7H12N2.2C6H7N3.C6H10N2O.C6H8N2O.C6H8N2.C5H5F3N2.C5H6N2/c1-8-4-3-5-12-11(8)14-7-10-6-9(2)13-15-10;1-8-4-3-5-11-10(8)9-6-12-13(2)7-9;1-8-3-2-4-11-10(8)13-5-9-6-14-7-12-9;1-7(2)11-9-8(3)5-4-6-10-9;1-7-9-4-5-11(7)6-8(12)10(2)3;1-7-3-2-5-10(6-4-9)8(7)11;1-6(2)8-5-10(4)7(3)9-8;1-4-5-8-6-10(3)7(2)9-8;1-3-10-8-7(2)5-4-6-9-8;1-3-9-6-4-5-7(2)8(9)10;1-3-10-8-6-4-5-7(2)9-8;1-3-8-7(2)5-4-6-9-8;1-5-3-6(8)4-9-7(5)10-2;1-10-5-6(4-9-10)7-8-2-3-11-7;1-6-9-3-4-10(6)5-7(11)8-2;1-6-8-4-7(5-10-3)9(6)2;1-5(2)7-4-8-6(3)9-7;1-3-4-7-5-8-6(2)9-7;1-5-3-6(4-7-2)9-8-5;1-6-8-3-5-9(6)4-2-7;1-5-3-6(4-9-2)8-7-5;1-5-6(9-2)3-4-7-8-5;1-5-3-7-4-8-6(5)2;1-10-4(2-3-9-10)5(6,7)8;1-5-6-3-2-4-7-5/h3-6H,7H2,1-2H3;3-7H,1-2H3;2-4,6-7H,5H2,1H3;4-7H,1-3H3;4-5H,6H2,1-3H3;2-3,5H,6H2,1H3;5-6H,1-4H3;6H,4-5H2,1-3H3;3*4-6H,3H2,1-2H3;4-6H,3H2,1-2H3;3-4H,1-2H3;2-5H,1H3;3-4H,5H2,1-2H3,(H,8,11);4H,5H2,1-3H3;4-5H,1-3H3,(H,8,9);5H,3-4H2,1-2H3,(H,8,9);3H,4H2,1H3,(H,8,9);3,5H,4H2,1H3;3H,4H2,1-2H3,(H,7,8);3-4H,1-2H3;3-4H,1-2H3;2-3H,1H3;2-4H,1H3
InChIKeyNZKKTUFXZYGZMU-UHFFFAOYSA-N
MW3552.91 g/mol
LogP34.14
Rot. Bonds35

About 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole

5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole (PubChem CID 159929164) has the molecular formula C186H252ClF3N50O15S and a molecular weight of 3552.91 g/mol. Its IUPAC name is 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole.

Molecular Properties

Compound Name5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole
PubChem CID159929164
Molecular FormulaC186H252ClF3N50O15S
Molecular Weight3552.91 g/mol
Exact Mass3549.99
IUPAC Name5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole
SMILESCCCc1cn(C)c(C)n1.CCCc1cnc(C)[nH]1.CCOc1cccc(C)n1.CCOc1ncccc1C.CCc1ncccc1C.CCn1cccc(C)c1=O.CNC(=O)Cn1ccnc1C.COCc1cc(C)[nH]n1.COCc1cnc(C)n1C.COc1ccnnc1C.COc1ncc(Cl)cc1C.Cc1cc(COc2ncccc2C)on1.Cc1cccn(CC#N)c1=O.Cc1cccnc1-c1cnn(C)c1.Cc1cccnc1OC(C)C.Cc1cccnc1OCc1cscn1.Cc1cncnc1C.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)[nH]1.Cc1ncccn1.Cc1nccn1CC#N.Cc1nccn1CC(=O)N(C)C.Cn1cc(-c2ncco2)cn1.Cn1nccc1C(F)(F)F.[C-]#[N+]Cc1cc(C)[nH]n1
InChIInChI=1S/C11H12N2O2.C10H11N3.C10H10N2OS.C9H13NO.C8H13N3O.C8H8N2O.2C8H14N2.3C8H11NO.C8H11N.C7H8ClNO.C7H7N3O.C7H11N3O.C7H12N2O.2C7H12N2.2C6H7N3.C6H10N2O.C6H8N2O.C6H8N2.C5H5F3N2.C5H6N2/c1-8-4-3-5-12-11(8)14-7-10-6-9(2)13-15-10;1-8-4-3-5-11-10(8)9-6-12-13(2)7-9;1-8-3-2-4-11-10(8)13-5-9-6-14-7-12-9;1-7(2)11-9-8(3)5-4-6-10-9;1-7-9-4-5-11(7)6-8(12)10(2)3;1-7-3-2-5-10(6-4-9)8(7)11;1-6(2)8-5-10(4)7(3)9-8;1-4-5-8-6-10(3)7(2)9-8;1-3-10-8-7(2)5-4-6-9-8;1-3-9-6-4-5-7(2)8(9)10;1-3-10-8-6-4-5-7(2)9-8;1-3-8-7(2)5-4-6-9-8;1-5-3-6(8)4-9-7(5)10-2;1-10-5-6(4-9-10)7-8-2-3-11-7;1-6-9-3-4-10(6)5-7(11)8-2;1-6-8-4-7(5-10-3)9(6)2;1-5(2)7-4-8-6(3)9-7;1-3-4-7-5-8-6(2)9-7;1-5-3-6(4-7-2)9-8-5;1-6-8-3-5-9(6)4-2-7;1-5-3-6(4-9-2)8-7-5;1-5-6(9-2)3-4-7-8-5;1-5-3-7-4-8-6(5)2;1-10-4(2-3-9-10)5(6,7)8;1-5-6-3-2-4-7-5/h3-6H,7H2,1-2H3;3-7H,1-2H3;2-4,6-7H,5H2,1H3;4-7H,1-3H3;4-5H,6H2,1-3H3;2-3,5H,6H2,1H3;5-6H,1-4H3;6H,4-5H2,1-3H3;3*4-6H,3H2,1-2H3;4-6H,3H2,1-2H3;3-4H,1-2H3;2-5H,1H3;3-4H,5H2,1-2H3,(H,8,11);4H,5H2,1-3H3;4-5H,1-3H3,(H,8,9);5H,3-4H2,1-2H3,(H,8,9);3H,4H2,1H3,(H,8,9);3,5H,4H2,1H3;3H,4H2,1-2H3,(H,7,8);3-4H,1-2H3;3-4H,1-2H3;2-3H,1H3;2-4H,1H3
InChIKeyNZKKTUFXZYGZMU-UHFFFAOYSA-N
XLogP34.14
TPSA748.93 Ų
H-Bond Donors5
H-Bond Acceptors59
Rotatable Bonds35
Heavy Atoms256
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003552.91
LogP ≤ 534.14
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1059

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole?
The IUPAC name of 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole (CID 159929164) is 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole.
What is the SMILES notation for 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole?
The canonical SMILES for 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole is CCCc1cn(C)c(C)n1.CCCc1cnc(C)[nH]1.CCOc1cccc(C)n1.CCOc1ncccc1C.CCc1ncccc1C.CCn1cccc(C)c1=O.CNC(=O)Cn1ccnc1C.COCc1cc(C)[nH]n1.COCc1cnc(C)n1C.COc1ccnnc1C.COc1ncc(Cl)cc1C.Cc1cc(COc2ncccc2C)on1.Cc1cccn(CC#N)c1=O.Cc1cccnc1-c1cnn(C)c1.Cc1cccnc1OC(C)C.Cc1cccnc1OCc1cscn1.Cc1cncnc1C.Cc1nc(C(C)C)cn1C.Cc1ncc(C(C)C)[nH]1.Cc1ncccn1.Cc1nccn1CC#N.Cc1nccn1CC(=O)N(C)C.Cn1cc(-c2ncco2)cn1.Cn1nccc1C(F)(F)F.[C-]#[N+]Cc1cc(C)[nH]n1.
What is the InChIKey of 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole?
The InChIKey is NZKKTUFXZYGZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2.C10H11N3.C10H10N2OS.C9H13NO.C8H13N3O.C8H8N2O.2C8H14N2.3C8H11NO.C8H11N.C7H8ClNO.C7H7N3O.C7H11N3O.C7H12N2O.2C7H12N2.2C6H7N3.C6H10N2O.C6H8N2O.C6H8N2.C5H5F3N2.C5H6N2/c1-8-4-3-5-12-11(8)14-7-10-6-9(2)13-15-10;1-8-4-3-5-11-10(8)9-6-12-13(2)7-9;1-8-3-2-4-11-10(8)13-5-9-6-14-7-12-9;1-7(2)11-9-8(3)5-4-6-10-9;1-7-9-4-5-11(7)6-8(12)10(2)3;1-7-3-2-5-10(6-4-9)8(7)11;1-6(2)8-5-10(4)7(3)9-8;1-4-5-8-6-10(3)7(2)9-8;1-3-10-8-7(2)5-4-6-9-8;1-3-9-6-4-5-7(2)8(9)10;1-3-10-8-6-4-5-7(2)9-8;1-3-8-7(2)5-4-6-9-8;1-5-3-6(8)4-9-7(5)10-2;1-10-5-6(4-9-10)7-8-2-3-11-7;1-6-9-3-4-10(6)5-7(11)8-2;1-6-8-4-7(5-10-3)9(6)2;1-5(2)7-4-8-6(3)9-7;1-3-4-7-5-8-6(2)9-7;1-5-3-6(4-7-2)9-8-5;1-6-8-3-5-9(6)4-2-7;1-5-3-6(4-9-2)8-7-5;1-5-6(9-2)3-4-7-8-5;1-5-3-7-4-8-6(5)2;1-10-4(2-3-9-10)5(6,7)8;1-5-6-3-2-4-7-5/h3-6H,7H2,1-2H3;3-7H,1-2H3;2-4,6-7H,5H2,1H3;4-7H,1-3H3;4-5H,6H2,1-3H3;2-3,5H,6H2,1H3;5-6H,1-4H3;6H,4-5H2,1-3H3;3*4-6H,3H2,1-2H3;4-6H,3H2,1-2H3;3-4H,1-2H3;2-5H,1H3;3-4H,5H2,1-2H3,(H,8,11);4H,5H2,1-3H3;4-5H,1-3H3,(H,8,9);5H,3-4H2,1-2H3,(H,8,9);3H,4H2,1H3,(H,8,9);3,5H,4H2,1H3;3H,4H2,1-2H3,(H,7,8);3-4H,1-2H3;3-4H,1-2H3;2-3H,1H3;2-4H,1H3.
What are the key properties of 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole?
5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole has a molecular weight of 3552.91 g/mol, XLogP of 34.14, 35 rotatable bonds, 5 hydrogen bond donors, and 59 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-3-methylpyridine;N,N-dimethyl-2-(2-methylimidazol-1-yl)acetamide;1,2-dimethyl-4-propan-2-ylimidazole;1,2-dimethyl-4-propylimidazole;4,5-dimethylpyrimidine;2-ethoxy-3-methylpyridine;2-ethoxy-6-methylpyridine;2-ethyl-3-methylpyridine;1-ethyl-3-methylpyridin-2-one;3-(isocyanomethyl)-5-methyl-1H-pyrazole;5-(methoxymethyl)-1,2-dimethylimidazole;3-(methoxymethyl)-5-methyl-1H-pyrazole;4-methoxy-3-methylpyridazine;2-(2-methylimidazol-1-yl)acetonitrile;N-methyl-2-(2-methylimidazol-1-yl)acetamide;3-methyl-2-(1-methylpyrazol-4-yl)pyridine;3-methyl-5-[(3-methyl-2-pyridinyl)oxymethyl]-1,2-oxazole;2-(3-methyl-2-oxo-1-pyridinyl)acetonitrile;2-methyl-5-propan-2-yl-1H-imidazole;3-methyl-2-propan-2-yloxypyridine;2-methyl-5-propyl-1H-imidazole;2-(1-methylpyrazol-4-yl)-1,3-oxazole;4-[(3-methyl-2-pyridinyl)oxymethyl]-1,3-thiazole;2-methylpyrimidine;1-methyl-5-(trifluoromethyl)pyrazole is sourced from PubChem (CID 159929164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).