bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine

C143H175Cl2N31O2S — CID 167546101

IUPACbis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)c1cc2cccnc2[nH]1.CC(C)c1cc2ccncc2[nH]1.CC(C)c1cc2cnccc2[nH]1.CC(C)c1cc2cnccc2o1.CC(C)c1ccc2c(N)noc2c1.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)nnn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1nc2ccncc2[nH]1.CC(C)c1nc2ccncc2n1C.CC(C)c1nc2cnccc2n1C.CC(C)c1nc2cnccc2s1.Cc1nn(C)c2ccc(C(C)C)cc12
InChIInChI=1S/C12H16N2.2C11H13ClN2.C11H14N2.3C10H13N3.C10H12N2O.3C10H12N2.C10H11NO.C9H11N3.C9H10N2S/c1-8(2)10-5-6-12-11(7-10)9(3)13-14(12)4;2*1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)10-12-8-6-11-5-4-9(8)13(10)3;1-7(2)10-12-8-4-5-11-6-9(8)13(10)3;1-7(2)8-4-5-10-9(6-8)11-12-13(10)3;1-6(2)7-3-4-8-9(5-7)13-12-10(8)11;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-7(2)9-5-8-3-4-11-6-10(8)12-9;1-7(2)9-6-8-4-3-5-11-10(8)12-9;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-6(2)9-11-7-3-4-10-5-8(7)12-9;1-6(2)9-11-7-5-10-4-3-8(7)12-9/h5-8H,1-4H3;2*4-7H,1-3H3;4-8H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3
InChIKeyBUSAOLGFHNVJMX-UHFFFAOYSA-N
MW2463.16 g/mol
LogP37.12
Rot. Bonds14

About bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine

bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine (PubChem CID 167546101) has the molecular formula C143H175Cl2N31O2S and a molecular weight of 2463.16 g/mol. Its IUPAC name is bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine.

Molecular Properties

Compound Namebis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
PubChem CID167546101
Molecular FormulaC143H175Cl2N31O2S
Molecular Weight2463.16 g/mol
Exact Mass2460.36
IUPAC Namebis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine
SMILESCC(C)c1cc2cccnc2[nH]1.CC(C)c1cc2ccncc2[nH]1.CC(C)c1cc2cnccc2[nH]1.CC(C)c1cc2cnccc2o1.CC(C)c1ccc2c(N)noc2c1.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)nnn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1nc2ccncc2[nH]1.CC(C)c1nc2ccncc2n1C.CC(C)c1nc2cnccc2n1C.CC(C)c1nc2cnccc2s1.Cc1nn(C)c2ccc(C(C)C)cc12
InChIInChI=1S/C12H16N2.2C11H13ClN2.C11H14N2.3C10H13N3.C10H12N2O.3C10H12N2.C10H11NO.C9H11N3.C9H10N2S/c1-8(2)10-5-6-12-11(7-10)9(3)13-14(12)4;2*1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)10-12-8-6-11-5-4-9(8)13(10)3;1-7(2)10-12-8-4-5-11-6-9(8)13(10)3;1-7(2)8-4-5-10-9(6-8)11-12-13(10)3;1-6(2)7-3-4-8-9(5-7)13-12-10(8)11;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-7(2)9-5-8-3-4-11-6-10(8)12-9;1-7(2)9-6-8-4-3-5-11-10(8)12-9;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-6(2)9-11-7-3-4-10-5-8(7)12-9;1-6(2)9-11-7-5-10-4-3-8(7)12-9/h5-8H,1-4H3;2*4-7H,1-3H3;4-8H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3
InChIKeyBUSAOLGFHNVJMX-UHFFFAOYSA-N
XLogP37.12
TPSA394.88 Ų
H-Bond Donors5
H-Bond Acceptors30
Rotatable Bonds14
Heavy Atoms179
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002463.16
LogP ≤ 537.12
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1030

Analyze bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine with MolForge

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Launch Full Analysis

Related Compounds

1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazole;2-(4-chlorophenyl)-5-methyl-1,3-thiazole;1,3-dimethylindole;1,3-dimethylpyrrolo[3,2-b]pyridine;3,5-dimethyl-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazole;2-ethoxy-3-propan-2-ylpyridine;7-methoxy-3-methyl-1H-indole;4-methoxy-2-methylquinoline;1-(4-methoxyphenyl)-4,5-dimethylpyrazole;5-(4-methoxyphenyl)-3-methyl-1,2-oxazole;4-methyl-2-(4-methylphenyl)-1,3-thiazole;3-methyl-5-phenylpyridine;4-methyl-2-piperidin-1-ylpyridine;3-propan-2-yl-2-pyrrolidin-1-ylpyridine
CID 160929028
2-chloro-5-propan-2-ylfuran;2-fluoro-4-propan-2-ylbenzonitrile;2-fluoro-5-propan-2-ylbenzonitrile;methane;2-methoxy-4-propan-2-ylpyridine;2-methyl-4-propan-2-ylbenzonitrile;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-ylthiophene;6-propan-2-yl-1H-benzimidazole;5-propan-2-yl-3H-benzimidazol-1-ium-1-carbonitrile;6-propan-2-yl-1,3-benzothiazole;1-(4-propan-2-ylphenyl)imidazole;4-(4-propan-2-ylphenyl)morpholine;1-(4-propan-2-ylphenyl)pyrrolidine;2-propan-2-yl-5-pyrazol-1-ylpyridine;5-propan-2-yl-2-pyrazol-1-ylpyridine;2-propan-2-ylthieno[2,3-b]pyridine;5-propan-2-ylthiophene-2-carbonitrile;2-propan-2-yl-5-(trifluoromethyl)thiophene
CID 161737560
5-(2-amino-1,3-benzothiazol-6-yl)-6-chloro-N-[[3-(trifluoromethoxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-1,3-benzothiazol-6-yl)-N-[[2-(cyclopropylmethoxy)phenyl]methyl]pyridine-3-carboxamide;5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-methyl-6-oxo-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]pyridine-3-carboxamide;6-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]-1H-benzimidazole-4-carboxamide;7-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]-3H-benzimidazole-5-carboxamide;4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]-1H-indole-6-carboxamide;6-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-N-[1-[2-(trifluoromethoxy)phenyl]ethyl]-1H-indole-4-carboxamide
CID 165043559
1,3-Ditert-butylbenzene;2,5-ditert-butyl-1-benzofuran;2,6-ditert-butyl-1-benzofuran;1,4-ditert-butyl-2,5-dimethylbenzene;3,6-ditert-butyl-2,4-dimethylpyridine;2,5-ditert-butyl-1-methylimidazole;2,4-ditert-butyl-1-methylindole;2,6-ditert-butyl-1-methylindole;3,5-ditert-butyl-1-methylpyrazole;3,6-ditert-butyl-4-methylpyridazine;2,5-ditert-butyl-1-methylpyrrole;2,5-ditert-butylpyrazine;2,4-ditert-butylpyridine;2,6-ditert-butylpyridine;3,5-ditert-butylpyridine;2,5-ditert-butyl-1,3-thiazole;2,5-ditert-butylthiophene;2,5-ditert-butyl-1,3,7-trimethylindole
CID 157077113
5-methyl-2H-benzotriazole;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;6-methyl-3H-imidazo[4,5-c]pyridine;6-methyl-1H-indazole;5-methyl-1H-pyrazolo[5,4-b]pyridine;6-methyl-1H-pyrazolo[4,5-b]pyridine;bis(5-methyl-1H-pyrazolo[5,4-c]pyridine);6-methyl-1H-pyrazolo[4,5-c]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;5-methyl-1H-pyrrolo[2,3-c]pyridine;2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157107655
5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;5-methyl-2,3-dihydroisoindol-1-one;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;6-methyl-3H-imidazo[4,5-c]pyridine;5-methyl-1H-indazole;6-methyl-1H-indazole;5-methyl-1H-indole;6-methyl-1H-indole;5-methyl-3H-isoindol-1-amine;5-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;6-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-c]pyridine;6-methyl-1H-pyrazolo[4,5-c]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;6-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;5-methyl-1H-pyrrolo[2,3-c]pyridine;6-methyl-1H-pyrrolo[3,2-c]pyridine;2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157153973
2-methyldibenzofuran;3-methyldibenzofuran;2-methyldibenzothiophene;7-methyl-5H-pyrazino[2,3-b]indole;8-methyl-5H-pyrazino[2,3-b]indole;7-methyl-5H-pyrimido[5,4-b]indole;7-methyl-9H-pyrimido[4,5-b]indole;8-methyl-5H-pyrimido[5,4-b]indole
CID 157238479
CID 157242582
CID 157242582
5-methyl-1,2-benzothiazol-3-amine;6-methyl-1,2-benzothiazol-3-amine;5-methyl-2H-benzotriazole;6-methyl-1,2-benzoxazol-3-amine;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydroisoindol-1-one;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;5-methyl-1H-indole;6-methyl-1H-indole;5-methyl-3H-isoindol-1-amine;6-methyl-3H-isoindol-1-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
CID 157360541
3-methyl-5H-cyclopenta[b]pyridine;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[3,2-c]pyridin-4-amine;3-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;3-methylimidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;5-methyl-3H-indazole;6-methyl-1H-indole;6-methyl-1H-isoindole;5-methyl-1H-pyrazolo[4,5-b]pyridine;5-methyl-1H-pyrazolo[5,4-b]pyridine;5-methyl-1H-pyrazolo[5,4-c]pyridine;3-methyl-5H-pyrrolo[3,4-b]pyridine;5-methyl-1H-pyrrolo[2,3-b]pyridine;5-methyl-1H-pyrrolo[3,2-b]pyridine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;3-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;5-methyl-1H-pyrrolo[2,3-c]pyridine;5-methyl-3H-pyrrolo[2,3-c]pyridine;bis(6-methyl-1H-pyrrolo[3,4-c]pyridine);2-methylthieno[3,2-c]pyridin-4-amine;3-methylthieno[3,2-c]pyridin-4-amine
CID 157361556
6-tert-butyl-1H-benzimidazol-2-amine;6-tert-butyl-1,2-benzothiazol-3-amine;6-tert-butyl-1-benzothiophen-3-amine;6-tert-butyl-1,2-benzoxazol-3-amine;6-tert-butyl-3-chloro-1,2-benzothiazole;6-tert-butyl-3-chloro-1-benzothiophene;bis(6-tert-butyl-3-chloro-1,2-benzoxazole);6-tert-butyl-3-chloro-2H-indazole;6-tert-butyl-3-chloro-1-methylindazole;6-tert-butyl-1H-indazol-3-amine;5-tert-butyl-1-methylbenzimidazol-2-amine;6-tert-butyl-1-methylbenzimidazol-2-amine;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-1-methylbenzimidazole;2-tert-butyl-3-methylfuro[2,3-c]pyridine;6-tert-butyl-1-methylindazol-3-amine;2-tert-butyl-3-methylthieno[2,3-c]pyridine
CID 157375356
6-tert-butyl-1H-benzimidazol-2-amine;6-tert-butyl-1,2-benzothiazol-3-amine;6-tert-butyl-1,2-benzoxazol-3-amine;6-tert-butyl-3-chloro-1,2-benzothiazole;6-tert-butyl-3-chloro-1,2-benzoxazole;6-tert-butyl-3-chloro-2H-indazole;2-tert-butyl-4-chloro-1-methylpyrrolo[2,3-c]pyridine;2-tert-butyl-4-chloro-1H-pyrrolo[2,3-c]pyridine;2-tert-butylfuro[2,3-c]pyridin-5-amine;6-tert-butyl-1H-indazol-3-amine;5-tert-butyl-1-methylbenzimidazol-2-amine;6-tert-butyl-1-methylbenzimidazol-2-amine;5-tert-butyl-1-methylbenzimidazole;6-tert-butyl-1-methylbenzimidazole;2-tert-butyl-3-methylfuro[2,3-c]pyridine;2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-5-amine;2-tert-butyl-1-methylpyrrolo[2,3-c]pyridine;2-tert-butyl-3-methylthieno[2,3-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-amine;2-tert-butylthieno[2,3-c]pyridin-5-amine
CID 157415264

Frequently Asked Questions

What is the IUPAC name of bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The IUPAC name of bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine (CID 167546101) is bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine.
What is the SMILES notation for bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The canonical SMILES for bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine is CC(C)c1cc2cccnc2[nH]1.CC(C)c1cc2ccncc2[nH]1.CC(C)c1cc2cnccc2[nH]1.CC(C)c1cc2cnccc2o1.CC(C)c1ccc2c(N)noc2c1.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)c(Cl)nn2C.CC(C)c1ccc2c(c1)nnn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1nc2ccncc2[nH]1.CC(C)c1nc2ccncc2n1C.CC(C)c1nc2cnccc2n1C.CC(C)c1nc2cnccc2s1.Cc1nn(C)c2ccc(C(C)C)cc12.
What is the InChIKey of bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
The InChIKey is BUSAOLGFHNVJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2.2C11H13ClN2.C11H14N2.3C10H13N3.C10H12N2O.3C10H12N2.C10H11NO.C9H11N3.C9H10N2S/c1-8(2)10-5-6-12-11(7-10)9(3)13-14(12)4;2*1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)10-12-8-6-11-5-4-9(8)13(10)3;1-7(2)10-12-8-4-5-11-6-9(8)13(10)3;1-7(2)8-4-5-10-9(6-8)11-12-13(10)3;1-6(2)7-3-4-8-9(5-7)13-12-10(8)11;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-7(2)9-5-8-3-4-11-6-10(8)12-9;1-7(2)9-6-8-4-3-5-11-10(8)12-9;1-7(2)10-5-8-6-11-4-3-9(8)12-10;1-6(2)9-11-7-3-4-10-5-8(7)12-9;1-6(2)9-11-7-5-10-4-3-8(7)12-9/h5-8H,1-4H3;2*4-7H,1-3H3;4-8H,1-3H3;3*4-7H,1-3H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;3-7H,1-2H3,(H,11,12);3-7H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3.
What are the key properties of bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine?
bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine has a molecular weight of 2463.16 g/mol, XLogP of 37.12, 14 rotatable bonds, 5 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-chloro-1-methyl-5-propan-2-ylindazole);1,3-dimethyl-5-propan-2-ylindazole;1-methyl-5-propan-2-ylbenzotriazole;1-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;3-methyl-2-propan-2-ylimidazo[4,5-c]pyridine;1-methyl-5-propan-2-ylindazole;6-propan-2-yl-1,2-benzoxazol-3-amine;2-propan-2-ylfuro[3,2-c]pyridine;2-propan-2-yl-3H-imidazo[4,5-c]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-1H-pyrrolo[3,2-c]pyridine;2-propan-2-yl-[1,3]thiazolo[4,5-c]pyridine is sourced from PubChem (CID 167546101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).