10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide

C117H128N12O11 — CID 163872312

IUPAC10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide
SMILESCCC(=O)CCCCCCC(=O)N1C(=O)C(c2c[nH]c3ccccc23)=C(C2C=Nc3ccccc32)C1=O.CCC(=O)CCCCCCN1C(=O)C(c2c(C)[nH]c3ccccc23)=C(c2c(C)[nH]c3ccccc23)C1=O.CNC(=O)CCCCCCC(=O)CC(c1c(C)[nH]c2ccccc12)c1c(C)[nH]c2ccccc12.CNC(=O)CCCCCCC(=O)CC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C31H33N3O3.C30H29N3O4.C29H35N3O2.C27H31N3O2/c1-4-21(35)13-7-5-6-12-18-34-30(36)28(26-19(2)32-24-16-10-8-14-22(24)26)29(31(34)37)27-20(3)33-25-17-11-9-15-23(25)27;1-2-19(34)11-5-3-4-6-16-26(35)33-29(36)27(22-17-31-24-14-9-7-12-20(22)24)28(30(33)37)23-18-32-25-15-10-8-13-21(23)25;1-19-28(22-13-8-10-15-25(22)31-19)24(29-20(2)32-26-16-11-9-14-23(26)29)18-21(33)12-6-4-5-7-17-27(34)30-3;1-28-27(32)15-5-3-2-4-10-19(31)16-22(23-17-29-25-13-8-6-11-20(23)25)24-18-30-26-14-9-7-12-21(24)26/h8-11,14-17,32-33H,4-7,12-13,18H2,1-3H3;7-10,12-15,17-18,22,32H,2-6,11,16H2,1H3;8-11,13-16,24,31-32H,4-7,12,17-18H2,1-3H3,(H,30,34);6-9,11-14,17-18,22,29-30H,2-5,10,15-16H2,1H3,(H,28,32)
InChIKeyPLWUEHIGUKFNLQ-UHFFFAOYSA-N
MW1878.38 g/mol
LogP24.38
Rot. Bonds42

About 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide

10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide (PubChem CID 163872312) has the molecular formula C117H128N12O11 and a molecular weight of 1878.38 g/mol. Its IUPAC name is 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide.

Molecular Properties

Compound Name10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide
PubChem CID163872312
Molecular FormulaC117H128N12O11
Molecular Weight1878.38 g/mol
Exact Mass1876.98
IUPAC Name10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide
SMILESCCC(=O)CCCCCCC(=O)N1C(=O)C(c2c[nH]c3ccccc23)=C(C2C=Nc3ccccc32)C1=O.CCC(=O)CCCCCCN1C(=O)C(c2c(C)[nH]c3ccccc23)=C(c2c(C)[nH]c3ccccc23)C1=O.CNC(=O)CCCCCCC(=O)CC(c1c(C)[nH]c2ccccc12)c1c(C)[nH]c2ccccc12.CNC(=O)CCCCCCC(=O)CC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
InChIInChI=1S/C31H33N3O3.C30H29N3O4.C29H35N3O2.C27H31N3O2/c1-4-21(35)13-7-5-6-12-18-34-30(36)28(26-19(2)32-24-16-10-8-14-22(24)26)29(31(34)37)27-20(3)33-25-17-11-9-15-23(25)27;1-2-19(34)11-5-3-4-6-16-26(35)33-29(36)27(22-17-31-24-14-9-7-12-20(22)24)28(30(33)37)23-18-32-25-15-10-8-13-21(23)25;1-19-28(22-13-8-10-15-25(22)31-19)24(29-20(2)32-26-16-11-9-14-23(26)29)18-21(33)12-6-4-5-7-17-27(34)30-3;1-28-27(32)15-5-3-2-4-10-19(31)16-22(23-17-29-25-13-8-6-11-20(23)25)24-18-30-26-14-9-7-12-21(24)26/h8-11,14-17,32-33H,4-7,12-13,18H2,1-3H3;7-10,12-15,17-18,22,32H,2-6,11,16H2,1H3;8-11,13-16,24,31-32H,4-7,12,17-18H2,1-3H3,(H,30,34);6-9,11-14,17-18,22,29-30H,2-5,10,15-16H2,1H3,(H,28,32)
InChIKeyPLWUEHIGUKFNLQ-UHFFFAOYSA-N
XLogP24.38
TPSA341.20 Ų
H-Bond Donors9
H-Bond Acceptors12
Rotatable Bonds42
Heavy Atoms140
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001878.38
LogP ≤ 524.38
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide with MolForge

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Related Compounds

8-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-N-methyl-8-oxooctanamide;6-[3,3-bis(1H-indol-3-yl)propanoylamino]-N-methylhexanamide;6-[3,3-bis(2-methyl-1H-indol-3-yl)propanoylamino]-N-methylhexanamide
CID 158692747
10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide
CID 161471783
3,4-bis(1H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;3,4-bis(1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione
CID 157130886
7-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-N-methylheptanamide;8-[3,4-bis(1H-indol-3-yl)-2,5-dioxopyrrol-1-yl]-N-methyl-8-oxooctanamide;1-[[5-(dimethylamino)naphthalen-1-yl]methyl]-N-(6-oxooctyl)-2,3-dihydroindole-2-carboxamide;3-methyl-N-(6-oxooctyl)-1H-indole-2-carboxamide;1-[(4-methylphenyl)methyl]-N-(6-oxooctyl)-2,3-dihydroindole-2-carboxamide
CID 158671034
hexane-2,4-dione;1-[4-(1H-indol-3-yl)-2-methyl-1H-pyrrol-3-yl]ethanone
CID 154689061
5-(methylamino)-5-(2-methyl-1H-indol-3-yl)pentanoic acid
CID 116953123
(4R)-4-(2-methyl-1H-indol-3-yl)-4-phenylbutan-2-one
CID 101252963
N-[2-(1H-indol-3-yl)-2-phenylethyl]pentanamide
CID 24599762
3-(3-ethyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)-4-(2-methyl-1H-indol-3-yl)-1-propylpyrrole-2,5-dione
CID 46110169
1-(1H-indol-3-yl)-1-thiophen-3-yloctan-4-one
CID 147397910
3,4-bis(1H-indol-3-yl)-1-methylpyrrole-2,5-dione
CID 2400
N-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]-4-(2,5-dioxoimidazolidin-1-yl)butanamide
CID 78802980

Frequently Asked Questions

What is the IUPAC name of 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide?
The IUPAC name of 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide (CID 163872312) is 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide.
What is the SMILES notation for 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide?
The canonical SMILES for 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide is CCC(=O)CCCCCCC(=O)N1C(=O)C(c2c[nH]c3ccccc23)=C(C2C=Nc3ccccc32)C1=O.CCC(=O)CCCCCCN1C(=O)C(c2c(C)[nH]c3ccccc23)=C(c2c(C)[nH]c3ccccc23)C1=O.CNC(=O)CCCCCCC(=O)CC(c1c(C)[nH]c2ccccc12)c1c(C)[nH]c2ccccc12.CNC(=O)CCCCCCC(=O)CC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12.
What is the InChIKey of 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide?
The InChIKey is PLWUEHIGUKFNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H33N3O3.C30H29N3O4.C29H35N3O2.C27H31N3O2/c1-4-21(35)13-7-5-6-12-18-34-30(36)28(26-19(2)32-24-16-10-8-14-22(24)26)29(31(34)37)27-20(3)33-25-17-11-9-15-23(25)27;1-2-19(34)11-5-3-4-6-16-26(35)33-29(36)27(22-17-31-24-14-9-7-12-20(22)24)28(30(33)37)23-18-32-25-15-10-8-13-21(23)25;1-19-28(22-13-8-10-15-25(22)31-19)24(29-20(2)32-26-16-11-9-14-23(26)29)18-21(33)12-6-4-5-7-17-27(34)30-3;1-28-27(32)15-5-3-2-4-10-19(31)16-22(23-17-29-25-13-8-6-11-20(23)25)24-18-30-26-14-9-7-12-21(24)26/h8-11,14-17,32-33H,4-7,12-13,18H2,1-3H3;7-10,12-15,17-18,22,32H,2-6,11,16H2,1H3;8-11,13-16,24,31-32H,4-7,12,17-18H2,1-3H3,(H,30,34);6-9,11-14,17-18,22,29-30H,2-5,10,15-16H2,1H3,(H,28,32).
What are the key properties of 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide?
10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide has a molecular weight of 1878.38 g/mol, XLogP of 24.38, 42 rotatable bonds, 9 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-bis(1H-indol-3-yl)-N-methyl-8-oxodecanamide;3,4-bis(2-methyl-1H-indol-3-yl)-1-(7-oxononyl)pyrrole-2,5-dione;3-(1H-indol-3-yl)-4-(3H-indol-3-yl)-1-(8-oxodecanoyl)pyrrole-2,5-dione;N-methyl-10,10-bis(2-methyl-1H-indol-3-yl)-8-oxodecanamide is sourced from PubChem (CID 163872312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).