2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole

C157H217Cl2N39O4S — CID 176523285

IUPAC2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole
SMILESCC(C)C1=CC2N=C(N3CCOCC3)C=CC2N1.CC(C)C1=CC2N=C(n3ccnc3)C=CC2N1.CC(C)C1=NC2C=CC=CC2N1.CC(C)C1=NC2C=CC=CC2O1.CC(C)C1=NC2C=CC=CC2S1.CC(C)C1=NC2C=CC=NC2N1.CC(C)c1ccc(Cl)nn1.CC(C)c1ccc2nccn2n1.CC(C)c1cccnn1.CC(C)c1ccnnc1.CC(C)c1cn[nH]n1.CC(C)c1cnccn1.COC1=NC2C=C(C(C)C)NC2C=C1.COc1ccc(C(C)C)nn1.Cc1cc2ccc(Cl)nn2c1C(C)C.Cc1ccc(C(C)C)nn1.Cc1ccc2nc(C)c(C(C)C)n2n1
InChIInChI=1S/C14H21N3O.C13H16N4.C11H13ClN2.C11H15N3.C11H16N2O.C10H14N2.C10H13NO.C10H13NS.C9H11N3.C9H13N3.C8H12N2O.C8H12N2.C7H9ClN2.3C7H10N2.C5H9N3/c1-10(2)12-9-13-11(15-12)3-4-14(16-13)17-5-7-18-8-6-17;1-9(2)11-7-12-10(15-11)3-4-13(16-12)17-6-5-14-8-17;1-7(2)11-8(3)6-9-4-5-10(12)13-14(9)11;1-7(2)11-9(4)12-10-6-5-8(3)13-14(10)11;1-7(2)9-6-10-8(12-9)4-5-11(13-10)14-3;3*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-3-4-9-10-5-6-12(9)11-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-4-7(8)10-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-9-5-7;1-6(2)7-4-3-5-8-9-7;1-4(2)5-3-6-8-7-5/h3-4,9-11,13,15H,5-8H2,1-2H3;3-10,12,15H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;4-8,10,12H,1-3H3;3-9H,1-2H3,(H,11,12);2*3-9H,1-2H3;3-7H,1-2H3;3-7,9H,1-2H3,(H,11,12);4-6H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3*3-6H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyUMBXPGMFORJOKC-UHFFFAOYSA-N
MW2817.70 g/mol
LogP30.54
Rot. Bonds18

About 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole

2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole (PubChem CID 176523285) has the molecular formula C157H217Cl2N39O4S and a molecular weight of 2817.70 g/mol. Its IUPAC name is 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole.

Molecular Properties

Compound Name2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole
PubChem CID176523285
Molecular FormulaC157H217Cl2N39O4S
Molecular Weight2817.70 g/mol
Exact Mass2814.71
IUPAC Name2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole
SMILESCC(C)C1=CC2N=C(N3CCOCC3)C=CC2N1.CC(C)C1=CC2N=C(n3ccnc3)C=CC2N1.CC(C)C1=NC2C=CC=CC2N1.CC(C)C1=NC2C=CC=CC2O1.CC(C)C1=NC2C=CC=CC2S1.CC(C)C1=NC2C=CC=NC2N1.CC(C)c1ccc(Cl)nn1.CC(C)c1ccc2nccn2n1.CC(C)c1cccnn1.CC(C)c1ccnnc1.CC(C)c1cn[nH]n1.CC(C)c1cnccn1.COC1=NC2C=C(C(C)C)NC2C=C1.COc1ccc(C(C)C)nn1.Cc1cc2ccc(Cl)nn2c1C(C)C.Cc1ccc(C(C)C)nn1.Cc1ccc2nc(C)c(C(C)C)n2n1
InChIInChI=1S/C14H21N3O.C13H16N4.C11H13ClN2.C11H15N3.C11H16N2O.C10H14N2.C10H13NO.C10H13NS.C9H11N3.C9H13N3.C8H12N2O.C8H12N2.C7H9ClN2.3C7H10N2.C5H9N3/c1-10(2)12-9-13-11(15-12)3-4-14(16-13)17-5-7-18-8-6-17;1-9(2)11-7-12-10(15-11)3-4-13(16-12)17-6-5-14-8-17;1-7(2)11-8(3)6-9-4-5-10(12)13-14(9)11;1-7(2)11-9(4)12-10-6-5-8(3)13-14(10)11;1-7(2)9-6-10-8(12-9)4-5-11(13-10)14-3;3*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-3-4-9-10-5-6-12(9)11-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-4-7(8)10-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-9-5-7;1-6(2)7-4-3-5-8-9-7;1-4(2)5-3-6-8-7-5/h3-4,9-11,13,15H,5-8H2,1-2H3;3-10,12,15H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;4-8,10,12H,1-3H3;3-9H,1-2H3,(H,11,12);2*3-9H,1-2H3;3-7H,1-2H3;3-7,9H,1-2H3,(H,11,12);4-6H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3*3-6H,1-2H3;3-4H,1-2H3,(H,6,7,8)
InChIKeyUMBXPGMFORJOKC-UHFFFAOYSA-N
XLogP30.54
TPSA490.94 Ų
H-Bond Donors6
H-Bond Acceptors43
Rotatable Bonds18
Heavy Atoms203
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002817.70
LogP ≤ 530.54
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1043

Analyze 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole with MolForge

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Related Compounds

6-chloro-2-propan-2-ylimidazo[1,2-b]pyridazine;6-cyclopropyl-2-propan-2-ylimidazo[1,2-b]pyridazine;6-fluoro-2-propan-2-ylimidazo[1,2-b]pyridazine;6-imidazol-1-yl-2-propan-2-ylimidazo[1,2-b]pyridazine;6-methoxy-2-propan-2-ylimidazo[1,2-b]pyridazine;6-methyl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;6-methyl-2-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-c]pyridine;2-propan-2-ylimidazo[1,2-a]pyridine;2-propan-2-ylimidazo[1,2-b]pyridazine;4-(2-propan-2-ylimidazo[1,2-b]pyridazin-6-yl)morpholine;2-propan-2-yl-6-pyrrolidin-1-ylimidazo[1,2-b]pyridazine;2-propan-2-yl-6-(trifluoromethyl)imidazo[1,2-b]pyridazine
CID 159223270
5-chloro-7-[(1S)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-7-[(1R)-1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;5-chloro-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)-3-methylsulfanylpropyl]pyrazolo[3,4-b]pyridine;3-[4-(5-chloro-4-methylimidazol-1-yl)-3-methoxyphenyl]-5-(1,1-difluoroethyl)-7-[1-(3,5-difluoro-4-methylphenyl)propyl]pyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)propyl]-5-(4-fluorophenyl)-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine
CID 159876189
6-chloro-2-methyl-3-propan-2-ylimidazo[1,2-b]pyridazine;2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-3-propan-2-yloxetane;3-methyl-6-propan-2-ylpyridazine;4-methyl-5-propan-2-ylthiadiazole;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;6-propan-2-ylimidazo[1,2-b]pyridazine;3-propan-2-yl-1H-indole;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;2-propan-2-ylpyrrolidin-3-ol;5-propan-2-ylpyrrolidin-3-ol;1-(2-propan-2-ylpyrrolidin-1-yl)ethanone;2-propan-2-ylthiolane 1,1-dioxide;4-propan-2-yl-2H-triazole
CID 157177784
(3S)-6-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;6-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine;(2S)-7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;(2R)-7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine;6-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methyl-1,2,3,4-tetrahydro-1,5-naphthyridine;7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2-methyl-1,2,3,4-tetrahydro-1,8-naphthyridine
CID 157903304
6-chloro-N-[6-(2-methylpyrrolidin-1-yl)-2-pyridinyl]imidazo[1,2-b]pyridazin-8-amine;6-(5-methoxy-3-pyridinyl)-N-[6-(2-methylpyrrolidin-1-yl)-2-pyridinyl]imidazo[1,2-b]pyridazin-8-amine
CID 158196345
10-chloro-5-(3,5-dimethylimidazol-4-yl)-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-(3,5-dimethylimidazol-4-yl)-13-fluoro-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,12-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-(3,5-dimethylimidazol-4-yl)-11-methoxy-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;2-[[5-(1,4-dimethylpyrazol-5-yl)-8-[oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-10-yl]amino]ethanol;4-[5-(1,4-dimethylpyrazol-5-yl)-8-[oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-10-yl]morpholine
CID 159597877
6-[5-(6-methyl-2-pyridinyl)-2-(phenoxymethyl)-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridine;6-[5-(6-methyl-2-pyridinyl)-2-(phenylsulfanylmethyl)-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridine;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
CID 160462466
11-chloro-5-(1,4-dimethylpyrazol-5-yl)-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-(3,5-dimethylimidazol-4-yl)-11-methoxy-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-(1,4-dimethylpyrazol-5-yl)-10-methoxy-8-[oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;2-[[5-(1,4-dimethylpyrazol-5-yl)-8-[oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-10-yl]amino]ethanol;4-[5-(1,4-dimethylpyrazol-5-yl)-8-[(S)-oxan-4-yl(phenyl)methyl]-3,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-10-yl]morpholine
CID 160917839
2-chloro-6-propan-2-ylpyridine;4-chloro-2-propan-2-ylpyridine;5-chloro-2-propan-2-ylpyridine;N,4-di(propan-2-yl)-1,3-thiazol-2-amine;2-methoxy-3-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;1-methyl-2-propan-2-ylimidazole;bis(2-methyl-5-propan-2-ylpyrazine);1-methyl-3-propan-2-ylpyrazole;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;3-methyl-4-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyrimidine;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;4-propan-2-yl-1,3-thiazole
CID 161231779
(3R)-4-[2-(6-chloro-1H-pyrrolo[2,3-b]pyridin-4-yl)-6-[3,5-dimethyl-1-(1-methylpiperidin-4-yl)pyrazol-4-yl]pyrimidin-4-yl]-3-methylmorpholine;(3R)-4-[6-[3,5-dimethyl-1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-2-(6-methoxy-1H-pyrrolo[2,3-b]pyridin-4-yl)pyrimidin-4-yl]-3-methylmorpholine;(3R)-4-[2-(1H-indazol-4-yl)-6-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-yl]-3-methylmorpholine;(3R)-3-methyl-4-[2-(1H-pyrazolo[3,4-b]pyridin-4-yl)-6-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-yl]morpholine;(3R)-3-methyl-4-[2-(1H-pyrrolo[2,3-c]pyridin-4-yl)-6-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-yl]morpholine
CID 167537329
2-chloro-4-[[1-(4-methoxyphenyl)imidazol-4-yl]methyl]pyrrolo[2,1-f][1,2,4]triazine;2,4-dichloropyrrolo[2,1-f][1,2,4]triazine;[(1R)-2-[4-[[1-(4-methoxyphenyl)imidazol-4-yl]methyl]pyrrolo[2,1-f][1,2,4]triazin-2-yl]cyclopentyl]methanol;1-(4-methylphenyl)imidazol-4-amine;[(2S)-pyrrolidin-2-yl]methanol
CID 167579792
N-(7-chloro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-methyl-1-(oxan-4-yl)pyrazolo[3,4-d]pyrimidin-6-amine;1-[(4-methoxyphenyl)methyl]-3-methyl-N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)pyrazolo[3,4-d]pyrimidin-6-amine;3-methyl-N-(7-methylimidazo[1,2-a]pyridin-6-yl)-1-(oxan-4-yl)pyrazolo[3,4-d]pyrimidin-6-amine;bis(3-methyl-N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1-(oxan-4-yl)pyrazolo[3,4-d]pyrimidin-6-amine);5-methyl-N-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-7-(oxan-4-yl)pyrrolo[2,3-d]pyrimidin-2-amine
CID 167600770

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole?
The IUPAC name of 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole (CID 176523285) is 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole.
What is the SMILES notation for 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole?
The canonical SMILES for 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole is CC(C)C1=CC2N=C(N3CCOCC3)C=CC2N1.CC(C)C1=CC2N=C(n3ccnc3)C=CC2N1.CC(C)C1=NC2C=CC=CC2N1.CC(C)C1=NC2C=CC=CC2O1.CC(C)C1=NC2C=CC=CC2S1.CC(C)C1=NC2C=CC=NC2N1.CC(C)c1ccc(Cl)nn1.CC(C)c1ccc2nccn2n1.CC(C)c1cccnn1.CC(C)c1ccnnc1.CC(C)c1cn[nH]n1.CC(C)c1cnccn1.COC1=NC2C=C(C(C)C)NC2C=C1.COc1ccc(C(C)C)nn1.Cc1cc2ccc(Cl)nn2c1C(C)C.Cc1ccc(C(C)C)nn1.Cc1ccc2nc(C)c(C(C)C)n2n1.
What is the InChIKey of 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole?
The InChIKey is UMBXPGMFORJOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O.C13H16N4.C11H13ClN2.C11H15N3.C11H16N2O.C10H14N2.C10H13NO.C10H13NS.C9H11N3.C9H13N3.C8H12N2O.C8H12N2.C7H9ClN2.3C7H10N2.C5H9N3/c1-10(2)12-9-13-11(15-12)3-4-14(16-13)17-5-7-18-8-6-17;1-9(2)11-7-12-10(15-11)3-4-13(16-12)17-6-5-14-8-17;1-7(2)11-8(3)6-9-4-5-10(12)13-14(9)11;1-7(2)11-9(4)12-10-6-5-8(3)13-14(10)11;1-7(2)9-6-10-8(12-9)4-5-11(13-10)14-3;3*1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-3-4-9-10-5-6-12(9)11-8;1-6(2)8-11-7-4-3-5-10-9(7)12-8;1-6(2)7-4-5-8(11-3)10-9-7;1-6(2)8-5-4-7(3)9-10-8;1-5(2)6-3-4-7(8)10-9-6;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-9-5-7;1-6(2)7-4-3-5-8-9-7;1-4(2)5-3-6-8-7-5/h3-4,9-11,13,15H,5-8H2,1-2H3;3-10,12,15H,1-2H3;4-7H,1-3H3;5-7H,1-4H3;4-8,10,12H,1-3H3;3-9H,1-2H3,(H,11,12);2*3-9H,1-2H3;3-7H,1-2H3;3-7,9H,1-2H3,(H,11,12);4-6H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3*3-6H,1-2H3;3-4H,1-2H3,(H,6,7,8).
What are the key properties of 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole?
2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole has a molecular weight of 2817.70 g/mol, XLogP of 30.54, 18 rotatable bonds, 6 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methyl-7-propan-2-ylpyrrolo[1,2-b]pyridazine;3-chloro-6-propan-2-ylpyridazine;2,6-dimethyl-3-propan-2-ylimidazo[1,2-b]pyridazine;5-imidazol-1-yl-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;5-methoxy-2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridine;3-methoxy-6-propan-2-ylpyridazine;3-methyl-6-propan-2-ylpyridazine;2-propan-2-yl-3a,7a-dihydro-1H-benzimidazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzothiazole;2-propan-2-yl-3a,7a-dihydro-1,3-benzoxazole;2-propan-2-yl-3a,7a-dihydro-3H-imidazo[4,5-b]pyridine;4-(2-propan-2-yl-3a,7a-dihydro-1H-pyrrolo[3,2-b]pyridin-5-yl)morpholine;6-propan-2-ylimidazo[1,2-b]pyridazine;2-propan-2-ylpyrazine;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;4-propan-2-yl-2H-triazole is sourced from PubChem (CID 176523285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).