10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide

C266H360ClI3N43O17+7 — CID 159083839

IUPAC10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide
SMILESC.CC(=O)OC(C)(C)C.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCI)c2c1.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCNCCN)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCC(=O)CCCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCCCNC(=O)c3cncc(C(=O)NCCCCCNC(=O)CCCCC[n+]4c5cc(N(C)C)ccc5cc5ccc(N(C)C)cc54)c3)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCCNCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)NCCCCCN)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)ON3C(=O)CCC3=O)c2c1.O=C(O)c1cccnc1.O=C=O.[Cl-].[I-].[I-]
InChIInChI=1S/C63H83N11O4.C49H64N7O2.C43H57N7.C28H41N5O.C27H33N4O4.C22H32N5.C20H25IN3.C6H5NO2.C6H12O2.CO2.CH4.ClH.2HI/c1-64-42-46-21-23-48-37-49-24-22-47(43-65-2)36-57(49)73(56(48)35-46)33-17-7-11-19-60(75)67-29-13-9-15-31-69-62(77)52-39-53(45-66-44-52)63(78)70-32-16-10-14-30-68-61(76)20-12-8-18-34-74-58-40-54(71(3)4)27-25-50(58)38-51-26-28-55(72(5)6)41-59(51)74;1-50-34-36-17-19-38-30-39-20-18-37(35-51-2)29-46(39)55(45(38)28-36)26-12-8-10-16-49(58)52-25-13-15-44(57)14-9-7-11-27-56-47-32-42(53(3)4)23-21-40(47)31-41-22-24-43(54(5)6)33-48(41)56;1-44-30-32-12-14-34-26-35-15-13-33(31-45-2)25-41(35)49(40(34)24-32)22-10-8-7-9-20-46-21-11-23-50-42-28-38(47(3)4)18-16-36(42)27-37-17-19-39(48(5)6)29-43(37)50;1-30-21-22-11-12-23-19-24-13-14-25(32(2)3)20-27(24)33(26(23)18-22)17-9-4-6-10-28(34)31-16-8-5-7-15-29;1-28-18-19-8-9-20-16-21-10-11-22(29(2)3)17-24(21)30(23(20)15-19)14-6-4-5-7-27(34)35-31-25(32)12-13-26(31)33;1-25(2)19-8-6-17-14-18-7-9-20(26(3)4)16-22(18)27(21(17)15-19)13-5-11-24-12-10-23;1-22(2)17-8-6-15-12-16-7-9-18(23(3)4)14-20(16)24(11-5-10-21)19(15)13-17;8-6(9)5-2-1-3-7-4-5;1-5(7)8-6(2,3)4;2-1-3;;;;/h21-28,35-41,44-45,64-65H,7-20,29-34,42-43H2,1-6H3,(H2-2,67,68,69,70,75,76,77,78);17-24,28-33,50-51H,7-16,25-27,34-35H2,1-6H3;12-19,24-29,44-46H,7-11,20-23,30-31H2,1-6H3;11-14,18-20,30H,4-10,15-17,21,29H2,1-3H3;8-11,15-17,28H,4-7,12-14,18H2,1-3H3;6-9,14-16,24H,5,10-13,23H2,1-4H3;6-9,12-14H,5,10-11H2,1-4H3;1-4H,(H,8,9);1-4H3;;1H4;3*1H/q;+1;+2;;3*+1;;;;;;;/p+1
InChIKeyCDTKVYJRIHZZQO-UHFFFAOYSA-O
MW4848.26 g/mol
LogP29.70
Rot. Bonds109

About 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide

10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide (PubChem CID 159083839) has the molecular formula C266H360ClI3N43O17+7 and a molecular weight of 4848.26 g/mol. Its IUPAC name is 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide.

Molecular Properties

Compound Name10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide
PubChem CID159083839
Molecular FormulaC266H360ClI3N43O17+7
Molecular Weight4848.26 g/mol
Exact Mass4844.54
IUPAC Name10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide
SMILESC.CC(=O)OC(C)(C)C.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCI)c2c1.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCNCCN)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCC(=O)CCCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCCCNC(=O)c3cncc(C(=O)NCCCCCNC(=O)CCCCC[n+]4c5cc(N(C)C)ccc5cc5ccc(N(C)C)cc54)c3)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCCNCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)NCCCCCN)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)ON3C(=O)CCC3=O)c2c1.O=C(O)c1cccnc1.O=C=O.[Cl-].[I-].[I-]
InChIInChI=1S/C63H83N11O4.C49H64N7O2.C43H57N7.C28H41N5O.C27H33N4O4.C22H32N5.C20H25IN3.C6H5NO2.C6H12O2.CO2.CH4.ClH.2HI/c1-64-42-46-21-23-48-37-49-24-22-47(43-65-2)36-57(49)73(56(48)35-46)33-17-7-11-19-60(75)67-29-13-9-15-31-69-62(77)52-39-53(45-66-44-52)63(78)70-32-16-10-14-30-68-61(76)20-12-8-18-34-74-58-40-54(71(3)4)27-25-50(58)38-51-26-28-55(72(5)6)41-59(51)74;1-50-34-36-17-19-38-30-39-20-18-37(35-51-2)29-46(39)55(45(38)28-36)26-12-8-10-16-49(58)52-25-13-15-44(57)14-9-7-11-27-56-47-32-42(53(3)4)23-21-40(47)31-41-22-24-43(54(5)6)33-48(41)56;1-44-30-32-12-14-34-26-35-15-13-33(31-45-2)25-41(35)49(40(34)24-32)22-10-8-7-9-20-46-21-11-23-50-42-28-38(47(3)4)18-16-36(42)27-37-17-19-39(48(5)6)29-43(37)50;1-30-21-22-11-12-23-19-24-13-14-25(32(2)3)20-27(24)33(26(23)18-22)17-9-4-6-10-28(34)31-16-8-5-7-15-29;1-28-18-19-8-9-20-16-21-10-11-22(29(2)3)17-24(21)30(23(20)15-19)14-6-4-5-7-27(34)35-31-25(32)12-13-26(31)33;1-25(2)19-8-6-17-14-18-7-9-20(26(3)4)16-22(18)27(21(17)15-19)13-5-11-24-12-10-23;1-22(2)17-8-6-15-12-16-7-9-18(23(3)4)14-20(16)24(11-5-10-21)19(15)13-17;8-6(9)5-2-1-3-7-4-5;1-5(7)8-6(2,3)4;2-1-3;;;;/h21-28,35-41,44-45,64-65H,7-20,29-34,42-43H2,1-6H3,(H2-2,67,68,69,70,75,76,77,78);17-24,28-33,50-51H,7-16,25-27,34-35H2,1-6H3;12-19,24-29,44-46H,7-11,20-23,30-31H2,1-6H3;11-14,18-20,30H,4-10,15-17,21,29H2,1-3H3;8-11,15-17,28H,4-7,12-14,18H2,1-3H3;6-9,14-16,24H,5,10-13,23H2,1-4H3;6-9,12-14H,5,10-11H2,1-4H3;1-4H,(H,8,9);1-4H3;;1H4;3*1H/q;+1;+2;;3*+1;;;;;;;/p+1
InChIKeyCDTKVYJRIHZZQO-UHFFFAOYSA-O
XLogP29.70
TPSA628.89 Ų
H-Bond Donors19
H-Bond Acceptors42
Rotatable Bonds109
Heavy Atoms330
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004848.26
LogP ≤ 529.70
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1042

Analyze 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-anilino-6-N-[2-[4-[3-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]propanoyl]piperazin-1-yl]-2-oxoethyl]-3-N-methylquinoline-3,6-dicarboxamide;4-anilino-3-(methylcarbamoyl)quinoline-6-carboxylic acid;tert-butyl 2-aminoacetate;tert-butyl 2-[[4-anilino-3-(methylcarbamoyl)quinoline-6-carbonyl]amino]acetate;tert-butyl 4-[2-[[4-anilino-3-(methylcarbamoyl)quinoline-6-carbonyl]amino]acetyl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]acetic acid;methane
CID 157342860
lithium;4-anilino-6-N-[3-[4-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]acetyl]piperazin-1-yl]-3-oxopropyl]-3-N-methylquinoline-3,6-dicarboxamide;3-[[4-anilino-3-(methylcarbamoyl)quinoline-6-carbonyl]amino]propanoic acid;4-anilino-3-(methylcarbamoyl)quinoline-6-carboxylic acid;tert-butyl 4-[3-[[4-anilino-3-(methylcarbamoyl)quinoline-6-carbonyl]amino]propanoyl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]acetic acid;methane;methyl 3-aminopropanoate;methyl 3-[[4-anilino-3-(methylcarbamoyl)quinoline-6-carbonyl]amino]propanoate;hydroxide
CID 157459012
4-anilino-6-[4-[4-[4-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]piperazin-1-yl]butylcarbamoyl]phenyl]-N-methylquinoline-3-carboxamide;4-[4-anilino-3-(methylcarbamoyl)quinolin-6-yl]benzoic acid;tert-butyl N-[4-[4-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]piperazin-1-yl]butyl]carbamate
CID 157465508
2-(2-Amino-5-pyridin-4-ylphenyl)-1-(7-piperazin-1-ylquinolin-3-yl)ethanone;tert-butyl 4-[3-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-pyridin-4-ylphenyl]acetyl]quinolin-7-yl]piperazine-1-carboxylate;7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-3-carboxylic acid
CID 158065962
10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;3-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-5-N-[3,6-bis(methylaminomethyl)acridin-10-ium-10-carbonyl]-5-N-[2-(propylamino)ethyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;pentane;pyridine-3-carboxylic acid;chloride;diiodide
CID 158533155
2-(2-Amino-5-pyridin-4-ylphenyl)-1-(7-piperazin-1-ylquinolin-3-yl)ethanone;tert-butyl 4-[3-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-pyridin-4-ylphenyl]acetyl]quinolin-7-yl]piperazine-1-carboxylate;6-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]naphthalene-2-carboxylic acid
CID 158867265
10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoic acid;10-[3-[5-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]pentylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;methyl 4-[[4-amino-5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-2-methylhexanoyl]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylate;methyl 4-[(4-amino-1-methylpyrrole-2-carbonyl)amino]-1-methylpyrrole-2-carboxylate;dichloride;diiodide
CID 158885809
2-(2-Amino-4-fluorophenyl)-1-(7-piperazin-1-ylquinolin-3-yl)ethanone;tert-butyl 4-[3-[2-[4-fluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]acetyl]quinolin-7-yl]piperazine-1-carboxylate;ethyl 7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-3-carboxylate;7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-3-carboxylic acid
CID 159328953
2-(2-Amino-4-fluorophenyl)-1-(7-piperazin-1-ylquinolin-3-yl)ethanone;tert-butyl 4-[3-[2-[5-fluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]acetyl]quinolin-7-yl]piperazine-1-carboxylate;ethyl 7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-3-carboxylate;7-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]quinoline-3-carboxylic acid
CID 159575307
6-[5-[8-[(8-amino-3,7-dimethyl-10-phenylphenazin-10-ium-2-yl)amino]octanoyl]-2-pyridinyl]-N-[7-(8-amino-3,7-dimethyl-10-phenylphenazin-10-ium-2-yl)heptyl]pyridine-3-carboxamide;tert-butyl 2-[8-[6-aminohexyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3,7-dimethyl-10-phenylphenazin-10-ium-2-yl]acetate;tert-butyl N-[3,7-dimethyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]-10-phenylphenazin-10-ium-2-yl]-N-[8-[6-[5-[6-[[3,7-dimethyl-8-[(2-methylpropan-2-yl)oxycarbonylamino]-10-phenylphenazin-10-ium-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexylcarbamoyl]-2-pyridinyl]-3-pyridinyl]-8-oxooctyl]carbamate;6-(5-carboxy-2-pyridinyl)pyridine-3-carboxylic acid;pentachloride
CID 160776566
10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanamide;3-N,5-N-bis[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]hexanamide;10-[6-[3-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]propylamino]hexyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;(2,5-dioxopyrrolidin-1-yl) 6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;5-methylpyridine-3-carboxylic acid;chloride;diiodide
CID 161523940
N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;3-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-5-N-[5-[2-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;pyridine-3-carboxylic acid;chloride
CID 161528404

Frequently Asked Questions

What is the IUPAC name of 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide?
The IUPAC name of 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide (CID 159083839) is 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide.
What is the SMILES notation for 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide?
The canonical SMILES for 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide is C.CC(=O)OC(C)(C)C.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCI)c2c1.CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCNCCN)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCC(=O)CCCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCC(=O)NCCCCCNC(=O)c3cncc(C(=O)NCCCCCNC(=O)CCCCC[n+]4c5cc(N(C)C)ccc5cc5ccc(N(C)C)cc54)c3)c2c1.CNCc1ccc2cc3ccc(CNC)cc3[n+](CCCCCCNCCC[n+]3c4cc(N(C)C)ccc4cc4ccc(N(C)C)cc43)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)NCCCCCN)c2c1.CNCc1ccc2cc3ccc(N(C)C)cc3[n+](CCCCCC(=O)ON3C(=O)CCC3=O)c2c1.O=C(O)c1cccnc1.O=C=O.[Cl-].[I-].[I-].
What is the InChIKey of 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide?
The InChIKey is CDTKVYJRIHZZQO-UHFFFAOYSA-O. The full InChI is InChI=1S/C63H83N11O4.C49H64N7O2.C43H57N7.C28H41N5O.C27H33N4O4.C22H32N5.C20H25IN3.C6H5NO2.C6H12O2.CO2.CH4.ClH.2HI/c1-64-42-46-21-23-48-37-49-24-22-47(43-65-2)36-57(49)73(56(48)35-46)33-17-7-11-19-60(75)67-29-13-9-15-31-69-62(77)52-39-53(45-66-44-52)63(78)70-32-16-10-14-30-68-61(76)20-12-8-18-34-74-58-40-54(71(3)4)27-25-50(58)38-51-26-28-55(72(5)6)41-59(51)74;1-50-34-36-17-19-38-30-39-20-18-37(35-51-2)29-46(39)55(45(38)28-36)26-12-8-10-16-49(58)52-25-13-15-44(57)14-9-7-11-27-56-47-32-42(53(3)4)23-21-40(47)31-41-22-24-43(54(5)6)33-48(41)56;1-44-30-32-12-14-34-26-35-15-13-33(31-45-2)25-41(35)49(40(34)24-32)22-10-8-7-9-20-46-21-11-23-50-42-28-38(47(3)4)18-16-36(42)27-37-17-19-39(48(5)6)29-43(37)50;1-30-21-22-11-12-23-19-24-13-14-25(32(2)3)20-27(24)33(26(23)18-22)17-9-4-6-10-28(34)31-16-8-5-7-15-29;1-28-18-19-8-9-20-16-21-10-11-22(29(2)3)17-24(21)30(23(20)15-19)14-6-4-5-7-27(34)35-31-25(32)12-13-26(31)33;1-25(2)19-8-6-17-14-18-7-9-20(26(3)4)16-22(18)27(21(17)15-19)13-5-11-24-12-10-23;1-22(2)17-8-6-15-12-16-7-9-18(23(3)4)14-20(16)24(11-5-10-21)19(15)13-17;8-6(9)5-2-1-3-7-4-5;1-5(7)8-6(2,3)4;2-1-3;;;;/h21-28,35-41,44-45,64-65H,7-20,29-34,42-43H2,1-6H3,(H2-2,67,68,69,70,75,76,77,78);17-24,28-33,50-51H,7-16,25-27,34-35H2,1-6H3;12-19,24-29,44-46H,7-11,20-23,30-31H2,1-6H3;11-14,18-20,30H,4-10,15-17,21,29H2,1-3H3;8-11,15-17,28H,4-7,12-14,18H2,1-3H3;6-9,14-16,24H,5,10-13,23H2,1-4H3;6-9,12-14H,5,10-11H2,1-4H3;1-4H,(H,8,9);1-4H3;;1H4;3*1H/q;+1;+2;;3*+1;;;;;;;/p+1.
What are the key properties of 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide?
10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide has a molecular weight of 4848.26 g/mol, XLogP of 29.70, 109 rotatable bonds, 19 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(2-aminoethylamino)propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;N-(5-aminopentyl)-6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;5-N-[5-[6-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]hexanoylamino]pentyl]-3-N-[5-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanoylamino]pentyl]pyridine-3,5-dicarboxamide;N-[9-[3,6-bis(dimethylamino)acridin-10-ium-10-yl]-4-oxononyl]-6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexanamide;10-[3-[6-[3,6-bis(methylaminomethyl)acridin-10-ium-10-yl]hexylamino]propyl]-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;tert-butyl acetate;carbon dioxide;(2,5-dioxopyrrolidin-1-yl) 6-[3-(dimethylamino)-6-(methylaminomethyl)acridin-10-ium-10-yl]hexanoate;10-(3-iodopropyl)-3-N,3-N,6-N,6-N-tetramethylacridin-10-ium-3,6-diamine;methane;pyridine-3-carboxylic acid;chloride;diiodide is sourced from PubChem (CID 159083839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).