2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide

C98H106Cl4F6N8O8 — CID 157405266

IUPAC2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide
SMILESCc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C25H26ClF3N2O2.C25H29ClN2O2.C24H24ClF3N2O2.C24H27ClN2O2/c1-15-5-10-20-18(13-15)19(14-21(32)30-12-11-24(2,3)4)22(25(27,28)29)31(20)23(33)16-6-8-17(26)9-7-16;1-16-6-11-22-21(14-16)20(15-23(29)27-13-12-25(3,4)5)17(2)28(22)24(30)18-7-9-19(26)10-8-18;1-14-5-10-19-17(11-14)18(12-20(31)29-13-23(2,3)4)21(24(26,27)28)30(19)22(32)15-6-8-16(25)9-7-15;1-15-6-11-21-20(12-15)19(13-22(28)26-14-24(3,4)5)16(2)27(21)23(29)17-7-9-18(25)10-8-17/h5-10,13H,11-12,14H2,1-4H3,(H,30,32);6-11,14H,12-13,15H2,1-5H3,(H,27,29);5-11H,12-13H2,1-4H3,(H,29,31);6-12H,13-14H2,1-5H3,(H,26,28)
InChIKeyBNQLDGVLSLLSQD-UHFFFAOYSA-N
MW1779.77 g/mol
LogP23.42
Rot. Bonds18

About 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide

2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide (PubChem CID 157405266) has the molecular formula C98H106Cl4F6N8O8 and a molecular weight of 1779.77 g/mol. Its IUPAC name is 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide.

Molecular Properties

Compound Name2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide
PubChem CID157405266
Molecular FormulaC98H106Cl4F6N8O8
Molecular Weight1779.77 g/mol
Exact Mass1776.68
IUPAC Name2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide
SMILESCc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C25H26ClF3N2O2.C25H29ClN2O2.C24H24ClF3N2O2.C24H27ClN2O2/c1-15-5-10-20-18(13-15)19(14-21(32)30-12-11-24(2,3)4)22(25(27,28)29)31(20)23(33)16-6-8-17(26)9-7-16;1-16-6-11-22-21(14-16)20(15-23(29)27-13-12-25(3,4)5)17(2)28(22)24(30)18-7-9-19(26)10-8-18;1-14-5-10-19-17(11-14)18(12-20(31)29-13-23(2,3)4)21(24(26,27)28)30(19)22(32)15-6-8-16(25)9-7-15;1-15-6-11-21-20(12-15)19(13-22(28)26-14-24(3,4)5)16(2)27(21)23(29)17-7-9-18(25)10-8-17/h5-10,13H,11-12,14H2,1-4H3,(H,30,32);6-11,14H,12-13,15H2,1-5H3,(H,27,29);5-11H,12-13H2,1-4H3,(H,29,31);6-12H,13-14H2,1-5H3,(H,26,28)
InChIKeyBNQLDGVLSLLSQD-UHFFFAOYSA-N
XLogP23.42
TPSA204.40 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms124
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001779.77
LogP ≤ 523.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide with MolForge

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Related Compounds

N-[(1R)-1-[2-chloro-5-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 71099356
1-[5-(3-benzylpyrrolidin-3-yl)-1H-indol-2-yl]-2,2,2-trifluoroethanone;1-[5-(1,3-dibenzylpyrrolidin-3-yl)-1H-indol-2-yl]-2,2,2-trifluoroethanone
CID 87450934
2-[5-chloro-1-[(2,4-dichlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;N-cyclopentyl-2-[1-[(2,4-dichlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-2-oxoacetamide
CID 87659849
2-[5-chloro-1-[(4-chlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopropyl-2-oxoacetamide;2-[1-[(4-chlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-cyclopropyl-2-oxoacetamide
CID 87661846
2-[5-chloro-1-[(4-chlorophenyl)methyl]-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide;2-[1-[(4-chlorophenyl)methyl]-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-cyclopentyl-2-oxoacetamide
CID 87662878
2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide
CID 121476902
Bis([4-[[[1-[(3-carbamimidoylphenyl)methyl]-5-chloroindole-2-carbonyl]amino]methyl]phenyl]-trimethylazanium);bis(2,2,2-trifluoroacetate)
CID 139902835
N-[[4-chloro-3-[2-[2-(4-fluorophenyl)-1-methylindol-5-yl]acetyl]phenyl]methyl]-2,2-dimethylpropanamide;N-[[5-[2-[2-(4-chlorophenyl)-1-ethylindol-5-yl]acetyl]-6-(difluoromethyl)-3-pyridinyl]methyl]-2-methylpropanamide;N-[[6-(difluoromethyl)-5-[2-(1-ethylindol-5-yl)acetyl]-3-pyridinyl]methyl]-2-methylpropanamide;N-[[6-(difluoromethyl)-5-[2-[1-methyl-2-[4-(trifluoromethyl)phenyl]indol-5-yl]acetyl]-3-pyridinyl]methyl]-2-methylpropanamide
CID 157675599
N-[[5-[2-[2-(2-chlorophenyl)-1-ethylindol-5-yl]acetyl]-6-(difluoromethyl)-3-pyridinyl]methyl]-2-fluoro-2-methylpropanamide;N-[[5-[2-[2-(3-chlorophenyl)-1-ethylindol-5-yl]acetyl]-6-(difluoromethyl)-3-pyridinyl]methyl]-2-fluoro-2-methylpropanamide;N-[[5-[2-[2-(4-chlorophenyl)-1-methylindol-5-yl]acetyl]-6-(difluoromethyl)-3-pyridinyl]methyl]-2-fluoro-2-methylpropanamide;N-[[6-(difluoromethyl)-5-[2-[1-ethyl-2-[4-(trifluoromethyl)phenyl]indol-5-yl]acetyl]-3-pyridinyl]methyl]-2-fluoro-2-methylpropanamide
CID 157743557
[1-(4-Chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(4-fluorophenyl)methanone;[1-(4-chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(3-methylphenyl)methanone;[1-(4-chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(4-methylphenyl)methanone;[1-(4-chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-(2,3,4,5,6-pentafluorophenyl)methanone;[1-(4-chlorophenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl]-[3-(trifluoromethyl)phenyl]methanone
CID 157809192
hexakis(carbon dioxide);N-[(1R)-1-(2-chloro-4-fluorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-chloro-4-fluorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2-chloro-3-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1R)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;2,3-dimethyl-1-[(4-phenylphenyl)methyl]-N-[(1S)-1-pyridin-3-ylethyl]indole-5-carboxamide;N-[(1R)-1-[4-fluoro-2-(trifluoromethyl)phenyl]ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide
CID 157943756
pentakis(carbon dioxide);N-[(1S)-1-(2-chloro-3-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;N-[(1S)-1-(2,3-difluorophenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide;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
CID 158097779

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide?
The IUPAC name of 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide (CID 157405266) is 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide.
What is the SMILES notation for 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide?
The canonical SMILES for 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide is Cc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C(F)(F)F)n2C(=O)c1ccc(Cl)cc1.Cc1ccc2c(c1)c(CC(=O)NCCC(C)(C)C)c(C)n2C(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide?
The InChIKey is BNQLDGVLSLLSQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26ClF3N2O2.C25H29ClN2O2.C24H24ClF3N2O2.C24H27ClN2O2/c1-15-5-10-20-18(13-15)19(14-21(32)30-12-11-24(2,3)4)22(25(27,28)29)31(20)23(33)16-6-8-17(26)9-7-16;1-16-6-11-22-21(14-16)20(15-23(29)27-13-12-25(3,4)5)17(2)28(22)24(30)18-7-9-19(26)10-8-18;1-14-5-10-19-17(11-14)18(12-20(31)29-13-23(2,3)4)21(24(26,27)28)30(19)22(32)15-6-8-16(25)9-7-15;1-15-6-11-21-20(12-15)19(13-22(28)26-14-24(3,4)5)16(2)27(21)23(29)17-7-9-18(25)10-8-17/h5-10,13H,11-12,14H2,1-4H3,(H,30,32);6-11,14H,12-13,15H2,1-5H3,(H,27,29);5-11H,12-13H2,1-4H3,(H,29,31);6-12H,13-14H2,1-5H3,(H,26,28).
What are the key properties of 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide?
2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide has a molecular weight of 1779.77 g/mol, XLogP of 23.42, 18 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-2,5-dimethylindol-3-yl]-N-(2,2-dimethylpropyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(3,3-dimethylbutyl)acetamide;2-[1-(4-chlorobenzoyl)-5-methyl-2-(trifluoromethyl)indol-3-yl]-N-(2,2-dimethylpropyl)acetamide is sourced from PubChem (CID 157405266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).