7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine

C225H271N51O3 — CID 159021075

IUPAC7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine
SMILESCC(C)c1[nH]nc2ccccc12.CC(C)c1[nH]nc2cnccc12.CC(C)c1[nH]nc2cncnc12.CC(C)c1[nH]nc2ncncc12.CC(C)c1c[nH]c2ccccc12.CC(C)c1c[nH]c2cnccc12.CC(C)c1c[nH]c2cncnc12.CC(C)c1c[nH]c2ncncc12.CC(C)c1ccc2[nH]ccc2c1.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2c(c1)CC(=O)N2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1cccc2c(N)noc12.CC(C)c1cnc2[nH]ccc2c1.CC(C)c1cnc2[nH]ccc2n1.CC(C)c1cnc2[nH]ncc2c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cncc2[nH]cnc12.CC(C)c1ncc2[nH]ccc2n1
InChIInChI=1S/2C11H13NO.4C11H13N.C10H12N2O.7C10H12N2.7C9H11N3.2C8H10N4/c1-7(2)8-3-4-10-9(5-8)6-11(13)12-10;1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)9-3-4-11-10(7-9)5-6-12-11;2*1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-6(2)7-4-3-5-8-9(7)13-12-10(8)11;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-7(2)9-5-12-10-6-11-4-3-8(9)10;1-7(2)9-5-8-3-4-11-10(8)12-6-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10;2*1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-6(2)7-4-11-9-8(7)3-10-5-12-9;1-6(2)7-3-11-8-4-10-5-12-9(7)8;1-6(2)7-3-10-4-8-9(7)12-5-11-8;1-6(2)7-3-8-5-11-12-9(8)10-4-7;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-6(2)9-7-3-4-10-5-8(7)11-12-9;1-6(2)8-5-11-9-7(12-8)3-4-10-9;1-5(2)7-8-6(11-12-7)3-9-4-10-8;1-5(2)7-6-3-9-4-10-8(6)12-11-7/h2*3-5,7H,6H2,1-2H3,(H,12,13);4*3-8,12H,1-2H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;5*3-7H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,11H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11);3-5H,1-2H3,(H,11,12);3-5H,1-2H3,(H,9,10,11,12)
InChIKeyJTSBGRXNJBHDEV-UHFFFAOYSA-N
MW3738.00 g/mol
LogP56.63
Rot. Bonds23

About 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine

7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine (PubChem CID 159021075) has the molecular formula C225H271N51O3 and a molecular weight of 3738.00 g/mol. Its IUPAC name is 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine
PubChem CID159021075
Molecular FormulaC225H271N51O3
Molecular Weight3738.00 g/mol
Exact Mass3735.26
IUPAC Name7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine
SMILESCC(C)c1[nH]nc2ccccc12.CC(C)c1[nH]nc2cnccc12.CC(C)c1[nH]nc2cncnc12.CC(C)c1[nH]nc2ncncc12.CC(C)c1c[nH]c2ccccc12.CC(C)c1c[nH]c2cnccc12.CC(C)c1c[nH]c2cncnc12.CC(C)c1c[nH]c2ncncc12.CC(C)c1ccc2[nH]ccc2c1.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2c(c1)CC(=O)N2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1cccc2c(N)noc12.CC(C)c1cnc2[nH]ccc2c1.CC(C)c1cnc2[nH]ccc2n1.CC(C)c1cnc2[nH]ncc2c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cncc2[nH]cnc12.CC(C)c1ncc2[nH]ccc2n1
InChIInChI=1S/2C11H13NO.4C11H13N.C10H12N2O.7C10H12N2.7C9H11N3.2C8H10N4/c1-7(2)8-3-4-10-9(5-8)6-11(13)12-10;1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)9-3-4-11-10(7-9)5-6-12-11;2*1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-6(2)7-4-3-5-8-9(7)13-12-10(8)11;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-7(2)9-5-12-10-6-11-4-3-8(9)10;1-7(2)9-5-8-3-4-11-10(8)12-6-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10;2*1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-6(2)7-4-11-9-8(7)3-10-5-12-9;1-6(2)7-3-11-8-4-10-5-12-9(7)8;1-6(2)7-3-10-4-8-9(7)12-5-11-8;1-6(2)7-3-8-5-11-12-9(8)10-4-7;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-6(2)9-7-3-4-10-5-8(7)11-12-9;1-6(2)8-5-11-9-7(12-8)3-4-10-9;1-5(2)7-8-6(11-12-7)3-9-4-10-8;1-5(2)7-6-3-9-4-10-8(6)12-11-7/h2*3-5,7H,6H2,1-2H3,(H,12,13);4*3-8,12H,1-2H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;5*3-7H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,11H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11);3-5H,1-2H3,(H,11,12);3-5H,1-2H3,(H,9,10,11,12)
InChIKeyJTSBGRXNJBHDEV-UHFFFAOYSA-N
XLogP56.63
TPSA774.08 Ų
H-Bond Donors23
H-Bond Acceptors32
Rotatable Bonds23
Heavy Atoms279
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003738.00
LogP ≤ 556.63
H-Bond Donors ≤ 523
H-Bond Acceptors ≤ 1032

Analyze 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine with MolForge

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Launch Full Analysis

Related Compounds

3-(1,1-difluoro-2,2-dimethylpropyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoro-2,2-dimethylpropyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-[(4-ethylpiperidin-1-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)-3-(2,4,4-trimethylpentyl)-1,2-benzoxazol-6-amine;N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-3-(2,4,4-trimethylpentyl)-1,2-benzoxazol-6-amine
CID 157662930
4-[2-(2,2-difluorocyclopropyl)-7-(3,5-dimethyl-1H-pyrazol-4-yl)-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole;4-[2-(difluoromethyl)-7-(3,5-dimethyl-1H-pyrazol-4-yl)-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole;3,5-dimethyl-4-[7-(6-methylquinolin-5-yl)-3H-benzimidazol-5-yl]-1,2-oxazole;4-[7-(1,4-dimethylpyrazol-5-yl)-3H-benzimidazol-5-yl]-3,5-dimethyl-1,2-oxazole
CID 158143448
N,N-dimethyl-3-[[6-methyl-7-(2-pyrazolo[1,5-a]pyrimidin-3-ylethynyl)-1,2-benzoxazol-3-yl]methyl]aniline;7-(2-imidazo[1,2-a]pyrazin-3-ylethynyl)-6-methyl-3-[[3-(3-methylpyrrol-1-yl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,2-a]pyridin-3-ylethynyl)-6-methyl-3-[[3-methyl-5-(piperidin-1-ylmethyl)phenyl]methyl]-1,2-benzoxazole
CID 158210941
3-(1,1-difluoropentyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(5,5-dimethylhexan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-3-(2-pyrrolidin-1-ylethyl)-1,2-benzoxazol-6-amine
CID 158313099
7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-3-[[3-(imidazol-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-6-methyl-1,2-benzoxazole;N-[[3-[[7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-1,2-benzoxazol-3-yl]methyl]-5-(trifluoromethyl)phenyl]methyl]cyclopropanamine;7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-3-[[3-(piperidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-3-[[3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole
CID 158470085
(E)-2-(2-aminopyrimidin-5-yl)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]prop-2-enamide;(E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]prop-2-enamide;(E)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]-2-(2-fluoro-3-pyridinyl)prop-2-enamide;(E)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]-2-(1H-indazol-6-yl)prop-2-enamide
CID 158765100
2-[6-cyclopropyl-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-(6-cyclopropyl-1-methylpiperidin-3-yl)-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[5,5-difluoro-1-[(2-fluorophenyl)methyl]piperidin-3-yl]-1-(3-pyridin-4-yl-1H-isoindol-5-yl)ethanone;1-[3-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)-1H-indazol-5-yl]-2-[(3S)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]ethanone;N-[(3R)-1-(1,2,4-oxadiazol-3-ylmethyl)piperidin-3-yl]-3-pyridin-4-yl-1H-indazole-5-carboxamide
CID 158765164
3-[2-[(3,3-difluorocyclobutyl)amino]prop-2-enyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(5,5-dimethylhexan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-[1-(6-methylidene-1H-pyridin-3-yl)ethyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine
CID 158926049
7-[2-(2H-benzotriazol-5-yl)ethynyl]-6-methyl-3-[[3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,5-a]pyridin-6-ylethynyl)-6-methyl-3-[[3-(piperidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;6-methyl-3-[[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]methyl]-7-[2-(1H-pyrazolo[3,4-c]pyridin-5-yl)ethynyl]-1,2-benzoxazole;6-methyl-3-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-7-[2-(tetrazolo[1,5-a]pyridin-6-yl)ethynyl]-1,2-benzoxazole
CID 159047536
3-[[3-(1,1-difluoroethyl)phenyl]methyl]-7-(2-indazol-2-ium-6-ylethynyl)-6-methyl-1,2-benzoxazole;3-[[3-(1,1-difluoroethyl)phenyl]methyl]-6-methyl-7-[2-(1H-pyrazolo[4,5-b]pyridin-5-yl)ethynyl]-1,2-benzoxazole;3-[[3-(1,1-difluoroethyl)phenyl]methyl]-6-methyl-7-[2-(1H-pyrazolo[5,4-b]pyridin-5-yl)ethynyl]-1,2-benzoxazole
CID 159297897
1-[3-(2,1,3-benzoxadiazol-5-yl)-1H-indazol-5-yl]-2-[(3S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]ethanone;1-[3-(2,1,3-benzoxadiazol-5-yl)-1H-indazol-5-yl]-2-[(3S,5R)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]ethanone;2-[(3S,5S)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3R,5R)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-[3-(2-methylindazol-5-yl)-1H-isoindol-5-yl]ethanone;2-[(3S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]-1-[3-([1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-isoindol-5-yl]ethanone
CID 159356126
methane;3-(4-methylphenyl)-5-propan-2-yl-1H-1,2,4-triazole;1-methyl-4-propan-2-ylbenzimidazole;1-methyl-5-propan-2-ylbenzimidazole;1-methyl-4-propan-2-ylindole;1-methyl-5-propan-2-ylindole;1-methyl-6-propan-2-ylindole;1-methyl-7-propan-2-ylindole;4-methyl-3-propan-2-yl-1H-1,2,4-triazole-5-thione;5-phenyl-3-propan-2-yl-1,2,4-oxadiazole;3-phenyl-5-propan-2-yl-1H-1,2,4-triazole;4-propan-2-yl-2H-benzotriazole;5-propan-2-yl-3H-indazole;6-propan-2-yl-1H-indene;7-propan-2-yl-1H-indene;4-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;3-propan-2-yl-5-pyridin-4-yl-1,2,4-oxadiazole;4-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)pyridine;3-propan-2-yl-5-[6-(trifluoromethyl)-3-pyridinyl]-1,2,4-oxadiazole
CID 159629313

Frequently Asked Questions

What is the IUPAC name of 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine?
The IUPAC name of 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine (CID 159021075) is 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine.
What is the SMILES notation for 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine?
The canonical SMILES for 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine is CC(C)c1[nH]nc2ccccc12.CC(C)c1[nH]nc2cnccc12.CC(C)c1[nH]nc2cncnc12.CC(C)c1[nH]nc2ncncc12.CC(C)c1c[nH]c2ccccc12.CC(C)c1c[nH]c2cnccc12.CC(C)c1c[nH]c2cncnc12.CC(C)c1c[nH]c2ncncc12.CC(C)c1ccc2[nH]ccc2c1.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2c(c1)CC(=O)N2.CC(C)c1ccc2c(c1)NC(=O)C2.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cc[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1ccc2cn[nH]c2c1.CC(C)c1cccc2c(N)noc12.CC(C)c1cnc2[nH]ccc2c1.CC(C)c1cnc2[nH]ccc2n1.CC(C)c1cnc2[nH]ncc2c1.CC(C)c1cncc2[nH]ccc12.CC(C)c1cncc2[nH]cnc12.CC(C)c1ncc2[nH]ccc2n1.
What is the InChIKey of 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine?
The InChIKey is JTSBGRXNJBHDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H13NO.4C11H13N.C10H12N2O.7C10H12N2.7C9H11N3.2C8H10N4/c1-7(2)8-3-4-10-9(5-8)6-11(13)12-10;1-7(2)8-3-4-9-6-11(13)12-10(9)5-8;1-8(2)9-3-4-11-10(7-9)5-6-12-11;2*1-8(2)10-4-3-9-5-6-12-11(9)7-10;1-8(2)10-7-12-11-6-4-3-5-9(10)11;1-6(2)7-4-3-5-8-9(7)13-12-10(8)11;1-7(2)9-5-11-6-10-8(9)3-4-12-10;1-7(2)9-5-12-10-6-11-4-3-8(9)10;1-7(2)9-5-8-3-4-11-10(8)12-6-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10;2*1-7(2)8-3-4-9-6-11-12-10(9)5-8;1-7(2)10-8-5-3-4-6-9(8)11-12-10;1-6(2)7-4-11-9-8(7)3-10-5-12-9;1-6(2)7-3-11-8-4-10-5-12-9(7)8;1-6(2)7-3-10-4-8-9(7)12-5-11-8;1-6(2)7-3-8-5-11-12-9(8)10-4-7;1-6(2)9-11-5-8-7(12-9)3-4-10-8;1-6(2)9-7-3-4-10-5-8(7)11-12-9;1-6(2)8-5-11-9-7(12-8)3-4-10-9;1-5(2)7-8-6(11-12-7)3-9-4-10-8;1-5(2)7-6-3-9-4-10-8(6)12-11-7/h2*3-5,7H,6H2,1-2H3,(H,12,13);4*3-8,12H,1-2H3;3-6H,1-2H3,(H2,11,12);2*3-7,12H,1-2H3;5*3-7H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,11H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11,12);3-6,10H,1-2H3;3-6H,1-2H3,(H,11,12);3-6H,1-2H3,(H,10,11);3-5H,1-2H3,(H,11,12);3-5H,1-2H3,(H,9,10,11,12).
What are the key properties of 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine?
7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine has a molecular weight of 3738.00 g/mol, XLogP of 56.63, 23 rotatable bonds, 23 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-yl-1,2-benzoxazol-3-amine;5-propan-2-yl-1,3-dihydroindol-2-one;6-propan-2-yl-1,3-dihydroindol-2-one;7-propan-2-yl-3H-imidazo[4,5-c]pyridine;3-propan-2-yl-2H-indazole;5-propan-2-yl-1H-indazole;bis(6-propan-2-yl-1H-indazole);3-propan-2-yl-1H-indole;5-propan-2-yl-1H-indole;bis(6-propan-2-yl-1H-indole);5-propan-2-yl-1H-pyrazolo[3,4-b]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-c]pyridine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidine;3-propan-2-yl-2H-pyrazolo[4,3-d]pyrimidine;2-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine;5-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;3-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;4-propan-2-yl-1H-pyrrolo[2,3-c]pyridine;2-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine;5-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidine;7-propan-2-yl-5H-pyrrolo[3,2-d]pyrimidine is sourced from PubChem (CID 159021075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).