5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate

C195H256Cl2F4N16O5 — CID 165079082

IUPAC5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate
SMILESCC(C)c1cc2c(F)cccc2n1C(C)C.CC(C)c1cc2cc(C#N)ccc2n1C(C)C.CC(C)c1cc2cc(Cl)ccc2n1C(C)C.CC(C)c1cc2ccc(C#N)cc2n1C(C)C.CC(C)c1cc2ccc(C(=O)NC3CC3)cc2n1C(C)C.CC(C)c1cc2ccc(C(F)(F)F)cc2n1C(C)C.CC(C)c1cc2ccc(Cl)cc2n1C(C)C.CC(C)c1cc2ccccc2n1C(C)C.COC(=O)c1ccc2cc(C(C)C)n(C(C)C)c2c1.COc1ccc2c(c1)cc(C(C)C)n2C(C)C.COc1ccc2cc(C(C)C)n(C(C)C)c2c1.Cc1ccc2c(c1)cc(C(C)C)n2C(C)C.Cc1ccc2cc(C(C)C)n(C(C)C)c2c1
InChIInChI=1S/C18H24N2O.C16H21NO2.C15H18F3N.2C15H18N2.2C15H21NO.2C15H21N.2C14H18ClN.C14H18FN.C14H19N/c1-11(2)16-9-13-5-6-14(18(21)19-15-7-8-15)10-17(13)20(16)12(3)4;1-10(2)14-8-12-6-7-13(16(18)19-5)9-15(12)17(14)11(3)4;1-9(2)13-7-11-5-6-12(15(16,17)18)8-14(11)19(13)10(3)4;1-10(2)15-8-13-7-12(9-16)5-6-14(13)17(15)11(3)4;1-10(2)14-8-13-6-5-12(9-16)7-15(13)17(14)11(3)4;1-10(2)15-9-12-8-13(17-5)6-7-14(12)16(15)11(3)4;1-10(2)14-8-12-6-7-13(17-5)9-15(12)16(14)11(3)4;1-10(2)15-9-13-8-12(5)6-7-14(13)16(15)11(3)4;1-10(2)14-9-13-7-6-12(5)8-15(13)16(14)11(3)4;1-9(2)14-8-11-7-12(15)5-6-13(11)16(14)10(3)4;1-9(2)13-7-11-5-6-12(15)8-14(11)16(13)10(3)4;1-9(2)14-8-11-12(15)6-5-7-13(11)16(14)10(3)4;1-10(2)14-9-12-7-5-6-8-13(12)15(14)11(3)4/h5-6,9-12,15H,7-8H2,1-4H3,(H,19,21);6-11H,1-5H3;5-10H,1-4H3;2*5-8,10-11H,1-4H3;2*6-11H,1-5H3;2*6-11H,1-5H3;3*5-10H,1-4H3;5-11H,1-4H3
InChIKeyUUXAYOUKIJJZTC-UHFFFAOYSA-N
MW3051.20 g/mol
LogP59.01
Rot. Bonds31

About 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate

5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate (PubChem CID 165079082) has the molecular formula C195H256Cl2F4N16O5 and a molecular weight of 3051.20 g/mol. Its IUPAC name is 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate.

Molecular Properties

Compound Name5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate
PubChem CID165079082
Molecular FormulaC195H256Cl2F4N16O5
Molecular Weight3051.20 g/mol
Exact Mass3047.96
IUPAC Name5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate
SMILESCC(C)c1cc2c(F)cccc2n1C(C)C.CC(C)c1cc2cc(C#N)ccc2n1C(C)C.CC(C)c1cc2cc(Cl)ccc2n1C(C)C.CC(C)c1cc2ccc(C#N)cc2n1C(C)C.CC(C)c1cc2ccc(C(=O)NC3CC3)cc2n1C(C)C.CC(C)c1cc2ccc(C(F)(F)F)cc2n1C(C)C.CC(C)c1cc2ccc(Cl)cc2n1C(C)C.CC(C)c1cc2ccccc2n1C(C)C.COC(=O)c1ccc2cc(C(C)C)n(C(C)C)c2c1.COc1ccc2c(c1)cc(C(C)C)n2C(C)C.COc1ccc2cc(C(C)C)n(C(C)C)c2c1.Cc1ccc2c(c1)cc(C(C)C)n2C(C)C.Cc1ccc2cc(C(C)C)n(C(C)C)c2c1
InChIInChI=1S/C18H24N2O.C16H21NO2.C15H18F3N.2C15H18N2.2C15H21NO.2C15H21N.2C14H18ClN.C14H18FN.C14H19N/c1-11(2)16-9-13-5-6-14(18(21)19-15-7-8-15)10-17(13)20(16)12(3)4;1-10(2)14-8-12-6-7-13(16(18)19-5)9-15(12)17(14)11(3)4;1-9(2)13-7-11-5-6-12(15(16,17)18)8-14(11)19(13)10(3)4;1-10(2)15-8-13-7-12(9-16)5-6-14(13)17(15)11(3)4;1-10(2)14-8-13-6-5-12(9-16)7-15(13)17(14)11(3)4;1-10(2)15-9-12-8-13(17-5)6-7-14(12)16(15)11(3)4;1-10(2)14-8-12-6-7-13(17-5)9-15(12)16(14)11(3)4;1-10(2)15-9-13-8-12(5)6-7-14(13)16(15)11(3)4;1-10(2)14-9-13-7-6-12(5)8-15(13)16(14)11(3)4;1-9(2)14-8-11-7-12(15)5-6-13(11)16(14)10(3)4;1-9(2)13-7-11-5-6-12(15)8-14(11)16(13)10(3)4;1-9(2)14-8-11-12(15)6-5-7-13(11)16(14)10(3)4;1-10(2)14-9-12-7-5-6-8-13(12)15(14)11(3)4/h5-6,9-12,15H,7-8H2,1-4H3,(H,19,21);6-11H,1-5H3;5-10H,1-4H3;2*5-8,10-11H,1-4H3;2*6-11H,1-5H3;2*6-11H,1-5H3;3*5-10H,1-4H3;5-11H,1-4H3
InChIKeyUUXAYOUKIJJZTC-UHFFFAOYSA-N
XLogP59.01
TPSA185.53 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds31
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003051.20
LogP ≤ 559.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate with MolForge

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Related Compounds

3-[[4-[3-[1-[(4-Tert-butylphenyl)methyl]-5-chloroindol-2-yl]-2-(cyclopropylmethyl)-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[3-[5-chloro-3-methyl-1-[[4-(trifluoromethoxy)phenyl]methyl]indol-2-yl]-2-methyl-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-[5-chloro-1-[3-(trifluoromethyl)phenyl]indole-2-carbonyl]-3,3-dimethylbutyl]benzoyl]amino]propanoic acid;3-[[4-[2-(cyclopropylmethyl)-3-oxo-3-[5-(trifluoromethoxy)-1-[4-(trifluoromethyl)phenyl]indol-2-yl]propyl]benzoyl]amino]propanoic acid
CID 157152355
5-chloro-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[cyclopropyl-(4-methoxyphenyl)methyl]-1H-indole-2-carboxamide;N-[1-(3-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide;5-methyl-N-[(4-methylphenyl)methyl]-1H-indole-2-carboxamide;5-methyl-N-(1-phenylethyl)-1H-indole-2-carboxamide;N-(1-phenylethyl)-1H-indole-2-carboxamide;N-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-indole-2-carboxamide
CID 157497105
2-[2-(4-aminophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-[2-(4-tert-butylphenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;2-[2-(3-chlorophenyl)ethynyl]-1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile;N-[4-[2-(3-cyano-1-ethyl-6-hydroxyindol-2-yl)ethynyl]phenyl]cyclopentanecarboxamide;1-ethyl-2-[2-(3-hydroxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile;1-ethyl-2-[2-(4-methoxyphenyl)ethynyl]-6-(trifluoromethyl)indole-3-carbonitrile
CID 157700281
3-[[4-[3-[1-[(4-Tert-butylphenyl)methyl]-5-chloroindol-2-yl]-2-(cyclopropylmethyl)-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-[5-chloro-1-[3-(trifluoromethyl)phenyl]indole-2-carbonyl]-3,3-dimethylbutyl]benzoyl]amino]propanoic acid;3-[[4-[2-[5-chloro-1-[3-(trifluoromethyl)phenyl]indole-2-carbonyl]-5-methylhexyl]benzoyl]amino]propanoic acid;3-[[4-[2-(cyclopropylmethyl)-3-oxo-3-[5-(trifluoromethoxy)-1-[4-(trifluoromethyl)phenyl]indol-2-yl]propyl]benzoyl]amino]propanoic acid
CID 157858703
bis(carbon dioxide);2-[4-[[5-[[(1S)-1-(4-chloro-3-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1S)-1-(4-ethylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1R)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;2-[4-[[5-[[(1S)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid
CID 158796973
benzyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;5-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-ethylindole-3-carbonitrile;6-chloro-1-(4-methoxyphenyl)indole-3-carbonitrile;ethyl N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]carbamate;1-ethyl-6-(trifluoromethyl)indole-3-carbonitrile
CID 159291447
tris(carbon dioxide);N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1S)-1-(4-ethylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1R)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;2-[4-[[5-[[(1S)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid
CID 160141104
tris(carbon dioxide);N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1S)-1-(4-ethyl-2-methoxyphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1R)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;2-[4-[[5-[[(1S)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid
CID 160307194
bis(carbon dioxide);N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1S)-1-(4-ethylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;N-[(1S)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2-[4-[[5-[[(1R)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid;2-[4-[[5-[[(1S)-1-(2-methoxy-4-methylphenyl)ethyl]carbamoyl]-2,3-dimethylindol-1-yl]methyl]phenyl]benzoic acid
CID 160758664
CID 161538210
CID 161538210
1-[[4-(2-cyanophenyl)phenyl]methyl]-N-[(1S)-1-(3,4-dichlorophenyl)ethyl]-2,3-dimethylindole-5-carboxamide;1-[[4-(2-cyanophenyl)phenyl]methyl]-2,3-dimethyl-N-[(1S)-1-(4-methylphenyl)ethyl]indole-5-carboxamide;1-[[4-(2-cyanophenyl)phenyl]methyl]-2,3-dimethyl-N-[(1S)-1-phenylethyl]indole-5-carboxamide;1-[[4-(2-cyanophenyl)phenyl]methyl]-N-[(1S)-1-(4-ethylphenyl)ethyl]-2,3-dimethylindole-5-carboxamide;1-[[4-(2-cyanophenyl)phenyl]methyl]-N-[(1S)-1-(3-fluorophenyl)ethyl]-2,3-dimethylindole-5-carboxamide;1-[[4-(2-cyanophenyl)phenyl]methyl]-N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,3-dimethylindole-5-carboxamide
CID 158428991
N-(4-chlorophenyl)-4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(3,4-dichlorophenyl)benzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-ethylbenzamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-(4-methylphenyl)benzamide;N-[3-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-2-methylpropanamide;4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-propan-2-ylbenzamide
CID 158497307

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate?
The IUPAC name of 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate (CID 165079082) is 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate.
What is the SMILES notation for 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate?
The canonical SMILES for 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate is CC(C)c1cc2c(F)cccc2n1C(C)C.CC(C)c1cc2cc(C#N)ccc2n1C(C)C.CC(C)c1cc2cc(Cl)ccc2n1C(C)C.CC(C)c1cc2ccc(C#N)cc2n1C(C)C.CC(C)c1cc2ccc(C(=O)NC3CC3)cc2n1C(C)C.CC(C)c1cc2ccc(C(F)(F)F)cc2n1C(C)C.CC(C)c1cc2ccc(Cl)cc2n1C(C)C.CC(C)c1cc2ccccc2n1C(C)C.COC(=O)c1ccc2cc(C(C)C)n(C(C)C)c2c1.COc1ccc2c(c1)cc(C(C)C)n2C(C)C.COc1ccc2cc(C(C)C)n(C(C)C)c2c1.Cc1ccc2c(c1)cc(C(C)C)n2C(C)C.Cc1ccc2cc(C(C)C)n(C(C)C)c2c1.
What is the InChIKey of 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate?
The InChIKey is UUXAYOUKIJJZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O.C16H21NO2.C15H18F3N.2C15H18N2.2C15H21NO.2C15H21N.2C14H18ClN.C14H18FN.C14H19N/c1-11(2)16-9-13-5-6-14(18(21)19-15-7-8-15)10-17(13)20(16)12(3)4;1-10(2)14-8-12-6-7-13(16(18)19-5)9-15(12)17(14)11(3)4;1-9(2)13-7-11-5-6-12(15(16,17)18)8-14(11)19(13)10(3)4;1-10(2)15-8-13-7-12(9-16)5-6-14(13)17(15)11(3)4;1-10(2)14-8-13-6-5-12(9-16)7-15(13)17(14)11(3)4;1-10(2)15-9-12-8-13(17-5)6-7-14(12)16(15)11(3)4;1-10(2)14-8-12-6-7-13(17-5)9-15(12)16(14)11(3)4;1-10(2)15-9-13-8-12(5)6-7-14(13)16(15)11(3)4;1-10(2)14-9-13-7-6-12(5)8-15(13)16(14)11(3)4;1-9(2)14-8-11-7-12(15)5-6-13(11)16(14)10(3)4;1-9(2)13-7-11-5-6-12(15)8-14(11)16(13)10(3)4;1-9(2)14-8-11-12(15)6-5-7-13(11)16(14)10(3)4;1-10(2)14-9-12-7-5-6-8-13(12)15(14)11(3)4/h5-6,9-12,15H,7-8H2,1-4H3,(H,19,21);6-11H,1-5H3;5-10H,1-4H3;2*5-8,10-11H,1-4H3;2*6-11H,1-5H3;2*6-11H,1-5H3;3*5-10H,1-4H3;5-11H,1-4H3.
What are the key properties of 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate?
5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate has a molecular weight of 3051.20 g/mol, XLogP of 59.01, 31 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1,2-di(propan-2-yl)indole;6-chloro-1,2-di(propan-2-yl)indole;N-cyclopropyl-1,2-di(propan-2-yl)indole-6-carboxamide;1,2-di(propan-2-yl)indole;1,2-di(propan-2-yl)indole-5-carbonitrile;1,2-di(propan-2-yl)indole-6-carbonitrile;1,2-di(propan-2-yl)-6-(trifluoromethyl)indole;4-fluoro-1,2-di(propan-2-yl)indole;5-methoxy-1,2-di(propan-2-yl)indole;6-methoxy-1,2-di(propan-2-yl)indole;5-methyl-1,2-di(propan-2-yl)indole;6-methyl-1,2-di(propan-2-yl)indole;methyl 1,2-di(propan-2-yl)indole-6-carboxylate is sourced from PubChem (CID 165079082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).