1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone

C114H138Cl4N10O10 — CID 159364158

IUPAC1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone
SMILESCC(=O)c1cn(CCCN2CCN(CCOc3ccc(Cl)cc3)CC2)c2c(C)cccc12.CCc1cccc2c(C(C)=O)cn(CCCN3CCC(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(=O)Cc3ccccc3)cn(CCCN3CCN(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(C)=O)cn(CC(C)CN3CCC(CCOc4ccc(Cl)cc4)CC3)c12
InChIInChI=1S/C32H36ClN3O3.C28H35ClN2O3.C28H35ClN2O2.C26H32ClN3O2/c1-38-31-10-5-9-28-29(30(37)23-25-7-3-2-4-8-25)24-36(32(28)31)16-6-15-34-17-19-35(20-18-34)21-22-39-27-13-11-26(33)12-14-27;1-20(18-31-19-26(21(2)32)25-5-4-6-27(33-3)28(25)31)17-30-14-11-22(12-15-30)13-16-34-24-9-7-23(29)8-10-24;1-3-23-6-4-7-26-27(21(2)32)20-31(28(23)26)16-5-15-30-17-12-22(13-18-30)14-19-33-25-10-8-24(29)9-11-25;1-20-5-3-6-24-25(21(2)31)19-30(26(20)24)12-4-11-28-13-15-29(16-14-28)17-18-32-23-9-7-22(27)8-10-23/h2-5,7-14,24H,6,15-23H2,1H3;4-10,19-20,22H,11-18H2,1-3H3;4,6-11,20,22H,3,5,12-19H2,1-2H3;3,5-10,19H,4,11-18H2,1-2H3
InChIKeyLIXKZAIYVZFRFN-UHFFFAOYSA-N
MW1950.23 g/mol
LogP23.66
Rot. Bonds41

About 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone

1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone (PubChem CID 159364158) has the molecular formula C114H138Cl4N10O10 and a molecular weight of 1950.23 g/mol. Its IUPAC name is 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone.

Molecular Properties

Compound Name1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone
PubChem CID159364158
Molecular FormulaC114H138Cl4N10O10
Molecular Weight1950.23 g/mol
Exact Mass1946.94
IUPAC Name1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone
SMILESCC(=O)c1cn(CCCN2CCN(CCOc3ccc(Cl)cc3)CC2)c2c(C)cccc12.CCc1cccc2c(C(C)=O)cn(CCCN3CCC(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(=O)Cc3ccccc3)cn(CCCN3CCN(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(C)=O)cn(CC(C)CN3CCC(CCOc4ccc(Cl)cc4)CC3)c12
InChIInChI=1S/C32H36ClN3O3.C28H35ClN2O3.C28H35ClN2O2.C26H32ClN3O2/c1-38-31-10-5-9-28-29(30(37)23-25-7-3-2-4-8-25)24-36(32(28)31)16-6-15-34-17-19-35(20-18-34)21-22-39-27-13-11-26(33)12-14-27;1-20(18-31-19-26(21(2)32)25-5-4-6-27(33-3)28(25)31)17-30-14-11-22(12-15-30)13-16-34-24-9-7-23(29)8-10-24;1-3-23-6-4-7-26-27(21(2)32)20-31(28(23)26)16-5-15-30-17-12-22(13-18-30)14-19-33-25-10-8-24(29)9-11-25;1-20-5-3-6-24-25(21(2)31)19-30(26(20)24)12-4-11-28-13-15-29(16-14-28)17-18-32-23-9-7-22(27)8-10-23/h2-5,7-14,24H,6,15-23H2,1H3;4-10,19-20,22H,11-18H2,1-3H3;4,6-11,20,22H,3,5,12-19H2,1-2H3;3,5-10,19H,4,11-18H2,1-2H3
InChIKeyLIXKZAIYVZFRFN-UHFFFAOYSA-N
XLogP23.66
TPSA162.82 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds41
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001950.23
LogP ≤ 523.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone with MolForge

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Related Compounds

1-[3-[3-[1-[2-[[[1-[3-[(5S)-3-[2-(3,5-dichlorophenyl)-2-oxoethyl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propyl]-7-methoxyindole-3-carbonyl]amino]methyl]-3-bicyclo[3.1.0]hexa-1,5-dienyl]-3-(4-fluorophenoxy)propan-2-yl]-3,8-diazabicyclo[3.2.1]octan-8-yl]propyl]-7-methoxy-N-[(2-methylphenyl)methyl]indole-3-carboxamide
CID 143502685
1-[1-[3-[4-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propyl]-7-ethylindol-3-yl]ethanone;1-[1-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone
CID 157889840
1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-[(3-methylphenyl)methyl]indole-3-carboxamide;1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-[(2-chlorophenyl)methyl]-1,4-diazepan-1-yl]propyl]-7-methoxy-N-(2-methylpropyl)indole-3-carboxamide;1-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propyl]-7-methoxy-N-[(3-methylphenyl)methyl]indole-3-carboxamide
CID 159353400
1-[1-[3-[4-(4-Chlorophenoxy)piperidin-1-yl]-2-hydroxypropyl]indol-3-yl]ethanone;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]-3-methylbutan-1-one;1-[1-[3-[4-(4-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]-2,2,2-trifluoroethanone
CID 159658562
1-[1-[3-(4-Benzoylpiperidin-1-yl)propyl]indol-3-yl]-3-methylbutan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[5-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[4-[4-(2-methoxyphenyl)piperidin-1-yl]butyl]indol-3-yl]ethanone;1-[1-[4-[4-(1-phenylethyl)piperazin-1-yl]butyl]indol-3-yl]ethanone;4-[1-[3-[4-(1-phenylethyl)piperazin-1-yl]propyl]indol-3-yl]butan-2-one
CID 159861540
1-[1-[3-[4-(3-Chlorophenoxy)piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-(3-chlorophenoxy)piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone;1-[1-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone
CID 160895395
2-[8-[3-(3-Acetyl-7-chloroindol-1-yl)propyl]-8-azabicyclo[3.2.1]octan-3-yl]-1-phenylethanone;2-[4-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperazin-1-yl]-1-morpholin-4-ylethanone;1-[1-[3-(4-butylpiperidin-1-yl)-2-methylpropyl]indol-3-yl]ethanone;4-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]butan-2-one;2,2,2-trifluoro-1-[1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone
CID 160952053
1-[1-[3-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)propyl]-7-methoxyindol-3-yl]ethanone;1-[7-methoxy-1-[3-(4-morpholin-4-ylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[7-methoxy-1-[3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]indol-3-yl]ethanone;1-[7-methyl-1-[3-(2-phenoxyethylamino)propyl]indol-3-yl]ethanone
CID 161132411
1-[1-[3-(4-Benzoylpiperidin-1-yl)propyl]indol-3-yl]-3-methylbutan-1-one;1-[1-[3-(4-benzoylpiperidin-1-yl)propyl]-5-methoxyindol-3-yl]pentan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]-3-methylbutan-1-one;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]-2,2,2-trifluoroethanone;1-[5-methoxy-1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone;2,2,2-trifluoro-1-[1-[3-[4-(2-methoxyphenyl)piperidin-1-yl]propyl]indol-3-yl]ethanone
CID 161678659
1-[1-[3-[4-(4-Chlorophenoxy)piperidin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone
CID 23642096
1-[1-[3-[3-(4-Chlorophenoxy)-8-azabicyclo[3.2.1]octan-8-yl]propyl]-7-methoxyindol-3-yl]ethanone
CID 23642097
1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-N-[(3-methylphenyl)methyl]-7-propan-2-yloxyindole-3-carboxamide
CID 58967562

Frequently Asked Questions

What is the IUPAC name of 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone?
The IUPAC name of 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone (CID 159364158) is 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone.
What is the SMILES notation for 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone?
The canonical SMILES for 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone is CC(=O)c1cn(CCCN2CCN(CCOc3ccc(Cl)cc3)CC2)c2c(C)cccc12.CCc1cccc2c(C(C)=O)cn(CCCN3CCC(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(=O)Cc3ccccc3)cn(CCCN3CCN(CCOc4ccc(Cl)cc4)CC3)c12.COc1cccc2c(C(C)=O)cn(CC(C)CN3CCC(CCOc4ccc(Cl)cc4)CC3)c12.
What is the InChIKey of 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone?
The InChIKey is LIXKZAIYVZFRFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H36ClN3O3.C28H35ClN2O3.C28H35ClN2O2.C26H32ClN3O2/c1-38-31-10-5-9-28-29(30(37)23-25-7-3-2-4-8-25)24-36(32(28)31)16-6-15-34-17-19-35(20-18-34)21-22-39-27-13-11-26(33)12-14-27;1-20(18-31-19-26(21(2)32)25-5-4-6-27(33-3)28(25)31)17-30-14-11-22(12-15-30)13-16-34-24-9-7-23(29)8-10-24;1-3-23-6-4-7-26-27(21(2)32)20-31(28(23)26)16-5-15-30-17-12-22(13-18-30)14-19-33-25-10-8-24(29)9-11-25;1-20-5-3-6-24-25(21(2)31)19-30(26(20)24)12-4-11-28-13-15-29(16-14-28)17-18-32-23-9-7-22(27)8-10-23/h2-5,7-14,24H,6,15-23H2,1H3;4-10,19-20,22H,11-18H2,1-3H3;4,6-11,20,22H,3,5,12-19H2,1-2H3;3,5-10,19H,4,11-18H2,1-2H3.
What are the key properties of 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone?
1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone has a molecular weight of 1950.23 g/mol, XLogP of 23.66, 41 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methoxyindol-3-yl]-2-phenylethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]propyl]-7-methylindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]-2-methylpropyl]-7-methoxyindol-3-yl]ethanone;1-[1-[3-[4-[2-(4-chlorophenoxy)ethyl]piperidin-1-yl]propyl]-7-ethylindol-3-yl]ethanone is sourced from PubChem (CID 159364158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).