1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid

C194H244N26O24 — CID 158896948

IUPAC1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid
SMILESCC(C)c1cc(CN2CCCCC2)cc2cc(C(=O)O)n(C)c12.CC(C)c1cn(CC(N)=O)c2ccc(C(=O)O)cc12.CC(C)c1cn(CC2(C)COC2)c2ccc(C(=O)O)cc12.COCCn1cc(C(C)=O)c2c(OC)ccc(C(C)C)c21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CCOCC4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CN(C(C)=O)C4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CCN4CCOCC4)n3)ccc21.COc1ccc(C(C)C)c2c1c(C(=O)O)cn2Cc1ccccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cc(C)ccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cccc(C)n1
InChIInChI=1S/C22H29N5O2.C22H31N5O2.C22H30N4O2.2C21H24N2O2.C19H20N2O3.C19H26N2O2.C17H21NO3.C17H23NO3.C14H16N2O3/c1-15(2)20-13-25(7-8-29-4)21-6-5-18(9-19(20)21)22-23-14-27(24-22)12-17-10-26(11-17)16(3)28;1-17(2)20-15-26(10-11-28-3)21-5-4-18(14-19(20)21)22-23-16-27(24-22)7-6-25-8-12-29-13-9-25;1-16(2)20-14-25(8-11-27-3)21-5-4-18(12-19(20)21)22-23-15-26(24-22)13-17-6-9-28-10-7-17;1-13(2)17-6-7-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-10-14(3)8-9-22-16;1-13(2)17-9-10-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-8-6-7-14(3)22-16;1-12(2)14-7-8-16(24-3)17-15(19(22)23)11-21(18(14)17)10-13-6-4-5-9-20-13;1-13(2)16-10-14(12-21-7-5-4-6-8-21)9-15-11-17(19(22)23)20(3)18(15)16;1-11(2)14-7-18(8-17(3)9-21-10-17)15-5-4-12(16(19)20)6-13(14)15;1-11(2)13-6-7-15(21-5)16-14(12(3)19)10-18(17(13)16)8-9-20-4;1-8(2)11-6-16(7-13(15)17)12-4-3-9(14(18)19)5-10(11)12/h5-6,9,13-15,17H,7-8,10-12H2,1-4H3;4-5,14-17H,6-13H2,1-3H3;4-5,12,14-17H,6-11,13H2,1-3H3;2*6-10,12-13H,11H2,1-5H3;4-9,11-12H,10H2,1-3H3,(H,22,23);9-11,13H,4-8,12H2,1-3H3,(H,22,23);4-7,11H,8-10H2,1-3H3,(H,19,20);6-7,10-11H,8-9H2,1-5H3;3-6,8H,7H2,1-2H3,(H2,15,17)(H,18,19)
InChIKeyJEYLMHVORNMQSO-UHFFFAOYSA-N
MW3324.24 g/mol
LogP36.67
Rot. Bonds55

About 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid

1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid (PubChem CID 158896948) has the molecular formula C194H244N26O24 and a molecular weight of 3324.24 g/mol. Its IUPAC name is 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid.

Molecular Properties

Compound Name1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid
PubChem CID158896948
Molecular FormulaC194H244N26O24
Molecular Weight3324.24 g/mol
Exact Mass3321.87
IUPAC Name1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid
SMILESCC(C)c1cc(CN2CCCCC2)cc2cc(C(=O)O)n(C)c12.CC(C)c1cn(CC(N)=O)c2ccc(C(=O)O)cc12.CC(C)c1cn(CC2(C)COC2)c2ccc(C(=O)O)cc12.COCCn1cc(C(C)=O)c2c(OC)ccc(C(C)C)c21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CCOCC4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CN(C(C)=O)C4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CCN4CCOCC4)n3)ccc21.COc1ccc(C(C)C)c2c1c(C(=O)O)cn2Cc1ccccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cc(C)ccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cccc(C)n1
InChIInChI=1S/C22H29N5O2.C22H31N5O2.C22H30N4O2.2C21H24N2O2.C19H20N2O3.C19H26N2O2.C17H21NO3.C17H23NO3.C14H16N2O3/c1-15(2)20-13-25(7-8-29-4)21-6-5-18(9-19(20)21)22-23-14-27(24-22)12-17-10-26(11-17)16(3)28;1-17(2)20-15-26(10-11-28-3)21-5-4-18(14-19(20)21)22-23-16-27(24-22)7-6-25-8-12-29-13-9-25;1-16(2)20-14-25(8-11-27-3)21-5-4-18(12-19(20)21)22-23-15-26(24-22)13-17-6-9-28-10-7-17;1-13(2)17-6-7-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-10-14(3)8-9-22-16;1-13(2)17-9-10-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-8-6-7-14(3)22-16;1-12(2)14-7-8-16(24-3)17-15(19(22)23)11-21(18(14)17)10-13-6-4-5-9-20-13;1-13(2)16-10-14(12-21-7-5-4-6-8-21)9-15-11-17(19(22)23)20(3)18(15)16;1-11(2)14-7-18(8-17(3)9-21-10-17)15-5-4-12(16(19)20)6-13(14)15;1-11(2)13-6-7-15(21-5)16-14(12(3)19)10-18(17(13)16)8-9-20-4;1-8(2)11-6-16(7-13(15)17)12-4-3-9(14(18)19)5-10(11)12/h5-6,9,13-15,17H,7-8,10-12H2,1-4H3;4-5,14-17H,6-13H2,1-3H3;4-5,12,14-17H,6-11,13H2,1-3H3;2*6-10,12-13H,11H2,1-5H3;4-9,11-12H,10H2,1-3H3,(H,22,23);9-11,13H,4-8,12H2,1-3H3,(H,22,23);4-7,11H,8-10H2,1-3H3,(H,19,20);6-7,10-11H,8-9H2,1-5H3;3-6,8H,7H2,1-2H3,(H2,15,17)(H,18,19)
InChIKeyJEYLMHVORNMQSO-UHFFFAOYSA-N
XLogP36.67
TPSA551.92 Ų
H-Bond Donors5
H-Bond Acceptors44
Rotatable Bonds55
Heavy Atoms244
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003324.24
LogP ≤ 536.67
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1044

Analyze 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

1-benzyl-3-propan-2-ylindole-5-carboxylic acid;1-[(3-cyanophenyl)methyl]-5-methyl-7-propan-2-ylindole-2-carboxylic acid;1-[(4-cyano-2-pyridinyl)methyl]-5-methyl-7-propan-2-ylindole-2-carboxylic acid;N,N-dimethyl-2-[5-(1-methyl-1,2,4-triazol-3-yl)-3-propan-2-ylindol-1-yl]acetamide;1-(2-methoxyethyl)-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(2-piperidin-1-ylethoxy)-7-propan-2-ylindole-2-carboxylic acid
CID 157175953
4-[[(6aS)-2-(hydroxymethyl)-12-oxo-7,8,9,10-tetrahydro-6aH-pyrido[2,1-c][1,4]benzodiazepin-3-yl]oxy]-N-[1-methyl-5-[2-[4-[1-methyl-5-[2-(4-methylphenyl)acetyl]pyrrol-3-yl]phenyl]acetyl]pyrrol-3-yl]butanamide;4-[[(6aS)-2-(hydroxymethyl)-12-oxo-7,8,9,10-tetrahydro-6aH-pyrido[2,1-c][1,4]benzodiazepin-3-yl]oxy]-N-[1-methyl-5-[2-[4-[1-methyl-2-(2-phenylacetyl)imidazol-4-yl]phenyl]acetyl]pyrrol-3-yl]butanamide;4-[[(6aS)-2-(hydroxymethyl)-12-oxo-7,8,9,10-tetrahydro-6aH-pyrido[2,1-c][1,4]benzodiazepin-3-yl]oxy]-N-[1-methyl-5-[2-[4-[1-methyl-5-(2-phenylacetyl)pyrrol-3-yl]phenyl]acetyl]pyrrol-3-yl]butanamide;methyl 4-[2-[4-[4-[2-[4-[4-[[(6aS)-2-(hydroxymethyl)-12-oxo-7,8,9,10-tetrahydro-6aH-pyrido[2,1-c][1,4]benzodiazepin-3-yl]oxy]butanoylamino]-1-methylpyrrol-2-yl]-2-oxoethyl]phenyl]-1-methylpyrrol-2-yl]-2-oxoethyl]benzoate
CID 157905743
5-(2-Methoxyethoxy)-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;5-(2-methoxyethoxy)-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;1-[5-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-2-yl]ethanone;1-[2-(4-methylpiperazin-1-yl)ethyl]-3-propan-2-ylindole-5-carboxylic acid;1-[2-(4-methylpiperazin-1-yl)ethyl]-3-propan-2-yl-5-pyrimidin-2-ylindole;1-[1-[(2-methyltriazol-4-yl)methyl]-7-propan-2-ylindol-2-yl]ethanone;3-propan-2-yl-5-pyrimidin-2-yl-1-(2-pyrrolidin-1-ylethyl)indole
CID 157927771
1-(2-Methoxyethyl)-5-methyl-7-propan-2-ylindole-2-carboxylic acid;4-methoxy-1-[(4-methoxy-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;5-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;1-methyl-5-(1-methyl-1,2,4-triazol-3-yl)-3-propan-2-ylindole;1-methyl-5-[1-(oxetan-3-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;3-propan-2-ylimidazo[1,2-a]pyridine-6-carboxylic acid;7-propan-2-yl-1-(pyridin-4-ylmethyl)indole-3-carboxylic acid
CID 158068277
Ethyl 6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine-3-carboxylate;3-methyl-6-[2-(6-methyl-2-pyridinyl)phenyl]imidazo[1,2-a]pyridine;6-[2-(3-methylpyrazol-1-yl)phenyl]imidazo[1,2-a]pyridine-3-carboxamide;5-[2-(6-methyl-2-pyridinyl)phenyl]-1-benzofuran-3-carboxamide;methyl 5-(2-pyridin-2-ylphenyl)pyrazolo[1,5-a]pyridine-3-carboxylate;5-[2-(6-methyl-2-pyridinyl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 158331535
1-[2-(Dimethylamino)ethyl]-3-propan-2-ylindole-5-carboxylic acid;1-(2-ethoxyethyl)-5-methyl-7-propan-2-ylindole-2-carboxylic acid;methane;1-(2-methoxyethyl)-5-[1-(oxetan-3-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;1-[5-methyl-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-2-yl]ethanone;1-[5-methyl-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-2-yl]ethanone;1-methyl-5-(1-methyl-1,2,4-triazol-3-yl)-3-propan-2-ylindole;5-methyl-7-propan-2-yl-1-(2-propan-2-yloxyethyl)indole-2-carboxylic acid;1-methyl-3-propan-2-ylpyrrolo[2,3-b]pyridine-5-carboxylic acid
CID 158385093
5-[1-(cyclopropylmethyl)-1,2,4-triazol-3-yl]-1-(2-methoxyethyl)-3-propan-2-ylindole;bis(5-[2-(dimethylamino)ethoxy]-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid);5-[2-(dimethylamino)ethoxy]-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-2-carboxylic acid;4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindole-2-carboxylic acid;4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;4-methoxy-5-phenylmethoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-2-carboxylic acid;1-methyl-5-(piperidine-1-carbonyl)-7-propan-2-ylindole-2-carboxylic acid;1-methyl-3-[3-propan-2-yl-1-(2-pyrrolidin-1-ylethyl)-1H-inden-5-yl]-1,2,4-triazole;1-(5-methyl-7-propan-2-ylpyrrolo[2,3-b]pyrazin-2-yl)ethanone;4-[2-[5-(1-methyl-1,2,4-triazol-3-yl)-3-propan-2-ylindol-1-yl]ethyl]morpholine
CID 158500897
1-[3-(4-hydroxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-[4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]ethane-1,2-dione;1-[4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-(2-methyl-3-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethane-1,2-dione;1-[4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-[3-(2-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethane-1,2-dione;1-[4-methoxy-7-(3-methyl-1,2,4-triazol-1-yl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-2-[3-(3-methylphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethane-1,2-dione
CID 158524424
1-[(4,6-Dimethyl-2-pyridinyl)methyl]-5-(2-methoxyethoxy)-7-propan-2-ylindole-3-carboxylic acid;5-[[4-(2-methoxyethoxy)piperidin-1-yl]methyl]-1-methyl-7-propan-2-ylindole-2-carboxylic acid;5-[(4-methoxypiperidin-1-yl)methyl]-1-methyl-7-propan-2-ylindole-2-carboxylic acid;2-(1-methyl-3-propan-2-ylindol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine;1-methyl-3-propan-2-yl-5-(1-pyridin-2-yl-1,2,4-triazol-3-yl)indole;1-(1-methyl-3-propan-2-ylpyrrolo[3,2-b]pyridin-5-yl)ethanone
CID 158712375
[(3S,3aR,6R,6aS)-6-tert-butyl-6-hydroxy-6a-methyl-2,3,3a,5-tetrahydrofuro[3,2-b]furan-3-yl] benzoate;3-tert-butylazetidin-3-ol;1-tert-butylcyclobutan-1-ol;1-tert-butylcyclopentan-1-ol;3-tert-butyl-3-fluorooxetane;1-(4-tert-butyl-4-hydroxypiperidin-1-yl)ethanone;(4-tert-butyl-4-hydroxypiperidin-1-yl)-(4-phenoxy-2-pyridinyl)methanone;3-tert-butyl-3-methoxyoxetane;7-tert-butyl-2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;7-tert-butyl-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;3-tert-butyl-3-methyloxetane;4-tert-butyl-1-methylpiperidin-4-ol;4-tert-butyloxan-4-ol;3-tert-butyloxetan-3-ol;(3-tert-butyloxetan-3-yl) 5-morpholin-4-ylpentanoate;4-tert-butylpiperidin-4-ol;5-(3,3-dimethylbutoxy)quinoline;6-(3,3-dimethylbutoxy)quinoline;7-(3,3-dimethylbutoxy)quinoline;2,2,3,3-tetramethylbutan-1-ol
CID 159205705
N,N-diethyl-2-propan-2-ylindazole-7-carboxamide;N,N-dimethyl-2-propan-2-ylindazole-7-carboxamide;6-methoxy-1-propan-2-ylbenzimidazole;methyl 2-propan-2-ylindazole-7-carboxylate;1-propan-2-ylimidazo[4,5-b]pyridine;2-propan-2-ylindazole-3-carboxylic acid;2-propan-2-ylindazole-7-carboxylic acid;7-propan-2-ylpurine;2-propan-2-ylpyrazolo[3,4-b]pyridine;4-propan-2-ylpyrrolo[3,2-b]pyridine;7-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylpyrrolo[3,2-c]pyridine;6-propan-2-ylpyrrolo[2,3-c]pyridine
CID 159315183
5,7-di(propan-2-yl)-1-(pyridin-2-ylmethyl)indole-2-carboxylic acid;N-hydroxy-1-methyl-3-propan-2-ylindole-5-carboxamide;1-(2-methoxyethyl)-7-propan-2-ylindole-2-carboxamide;1-(2-methoxyethyl)-4-propan-2-ylindole-2-carboxylic acid;1-[(6-methoxy-2-pyridinyl)methyl]-7-propan-2-ylindole-2-carboxylic acid;1-methyl-5,7-di(propan-2-yl)indole-2-carboxylic acid;1-methyl-5-(1-methyltetrazol-5-yl)-3-propan-2-ylindole;1-methyl-7-propan-2-ylindole-3-carboxamide
CID 159596948

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid?
The IUPAC name of 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid (CID 158896948) is 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid.
What is the SMILES notation for 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid?
The canonical SMILES for 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid is CC(C)c1cc(CN2CCCCC2)cc2cc(C(=O)O)n(C)c12.CC(C)c1cn(CC(N)=O)c2ccc(C(=O)O)cc12.CC(C)c1cn(CC2(C)COC2)c2ccc(C(=O)O)cc12.COCCn1cc(C(C)=O)c2c(OC)ccc(C(C)C)c21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CCOCC4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CC4CN(C(C)=O)C4)n3)ccc21.COCCn1cc(C(C)C)c2cc(-c3ncn(CCN4CCOCC4)n3)ccc21.COc1ccc(C(C)C)c2c1c(C(=O)O)cn2Cc1ccccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cc(C)ccn1.COc1ccc(C(C)C)c2c1c(C(C)=O)cn2Cc1cccc(C)n1.
What is the InChIKey of 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid?
The InChIKey is JEYLMHVORNMQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O2.C22H31N5O2.C22H30N4O2.2C21H24N2O2.C19H20N2O3.C19H26N2O2.C17H21NO3.C17H23NO3.C14H16N2O3/c1-15(2)20-13-25(7-8-29-4)21-6-5-18(9-19(20)21)22-23-14-27(24-22)12-17-10-26(11-17)16(3)28;1-17(2)20-15-26(10-11-28-3)21-5-4-18(14-19(20)21)22-23-16-27(24-22)7-6-25-8-12-29-13-9-25;1-16(2)20-14-25(8-11-27-3)21-5-4-18(12-19(20)21)22-23-15-26(24-22)13-17-6-9-28-10-7-17;1-13(2)17-6-7-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-10-14(3)8-9-22-16;1-13(2)17-9-10-19(25-5)20-18(15(4)24)12-23(21(17)20)11-16-8-6-7-14(3)22-16;1-12(2)14-7-8-16(24-3)17-15(19(22)23)11-21(18(14)17)10-13-6-4-5-9-20-13;1-13(2)16-10-14(12-21-7-5-4-6-8-21)9-15-11-17(19(22)23)20(3)18(15)16;1-11(2)14-7-18(8-17(3)9-21-10-17)15-5-4-12(16(19)20)6-13(14)15;1-11(2)13-6-7-15(21-5)16-14(12(3)19)10-18(17(13)16)8-9-20-4;1-8(2)11-6-16(7-13(15)17)12-4-3-9(14(18)19)5-10(11)12/h5-6,9,13-15,17H,7-8,10-12H2,1-4H3;4-5,14-17H,6-13H2,1-3H3;4-5,12,14-17H,6-11,13H2,1-3H3;2*6-10,12-13H,11H2,1-5H3;4-9,11-12H,10H2,1-3H3,(H,22,23);9-11,13H,4-8,12H2,1-3H3,(H,22,23);4-7,11H,8-10H2,1-3H3,(H,19,20);6-7,10-11H,8-9H2,1-5H3;3-6,8H,7H2,1-2H3,(H2,15,17)(H,18,19).
What are the key properties of 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid?
1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid has a molecular weight of 3324.24 g/mol, XLogP of 36.67, 55 rotatable bonds, 5 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-oxoethyl)-3-propan-2-ylindole-5-carboxylic acid;1-(2-methoxyethyl)-5-[1-(oxan-4-ylmethyl)-1,2,4-triazol-3-yl]-3-propan-2-ylindole;4-[2-[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]ethyl]morpholine;1-[3-[[3-[1-(2-methoxyethyl)-3-propan-2-ylindol-5-yl]-1,2,4-triazol-1-yl]methyl]azetidin-1-yl]ethanone;1-[4-methoxy-1-(2-methoxyethyl)-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(4-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;1-[4-methoxy-1-[(6-methyl-2-pyridinyl)methyl]-7-propan-2-ylindol-3-yl]ethanone;4-methoxy-7-propan-2-yl-1-(pyridin-2-ylmethyl)indole-3-carboxylic acid;1-[(3-methyloxetan-3-yl)methyl]-3-propan-2-ylindole-5-carboxylic acid;1-methyl-5-(piperidin-1-ylmethyl)-7-propan-2-ylindole-2-carboxylic acid is sourced from PubChem (CID 158896948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).