acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide

C144H145Br2CuN20O11Pd — CID 159585239

About acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide

acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide (PubChem CID 159585239) has the molecular formula C144H145Br2CuN20O11Pd and a molecular weight of 2661.65 g/mol. Its IUPAC name is acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide.

Molecular Properties

• Compound Name: acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide
• PubChem CID: 159585239
• Molecular Formula: C144H145Br2CuN20O11Pd
• Molecular Weight: 2661.65 g/mol
• Exact Mass: 2656.81
• IUPAC Name: acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide
• SMILES: Brc1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.CC(=O)O.CC(=O)O.CC(=O)n1c2c(c3cc(Br)ccc31)CCCC2n1cccc1.COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.O=C(O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.[C-]#N.[C-]#[N+]c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.[Cu+].[Pd].c1ccc2c3c([nH]c2c1)C(n1cccc1)CCC3.c1ccn(C2CCCc3c2[nH]c2ccc(N4CCOCC4)cc32)c1
• InChI: InChI=1S/C20H23N3O.C18H17BrN2O.C18H18N2O2.C17H17N3O.C17H15N3.C17H16N2O2.C16H15BrN2.C16H16N2.2C2H4O2.CN.Cu.Pd/c1-2-9-23(8-1)19-5-3-4-16-17-14-15(22-10-12-24-13-11-22)6-7-18(17)21-20(16)19;1-12(22)21-16-8-7-13(19)11-15(16)14-5-4-6-17(18(14)21)20-9-2-3-10-20;1-22-18(21)12-7-8-15-14(11-12)13-5-4-6-16(17(13)19-15)20-9-2-3-10-20;18-17(21)11-6-7-14-13(10-11)12-4-3-5-15(16(12)19-14)20-8-1-2-9-20;1-18-12-7-8-15-14(11-12)13-5-4-6-16(17(13)19-15)20-9-2-3-10-20;20-17(21)11-6-7-14-13(10-11)12-4-3-5-15(16(12)18-14)19-8-1-2-9-19;17-11-6-7-14-13(10-11)12-4-3-5-15(16(12)18-14)19-8-1-2-9-19;1-2-8-14-12(6-1)13-7-5-9-15(16(13)17-14)18-10-3-4-11-18;2*1-2(3)4;1-2;;/h1-2,6-9,14,19,21H,3-5,10-13H2;2-3,7-11,17H,4-6H2,1H3;2-3,7-11,16,19H,4-6H2,1H3;1-2,6-10,15,19H,3-5H2,(H2,18,21);2-3,7-11,16,19H,4-6H2;1-2,6-10,15,18H,3-5H2,(H,20,21);1-2,6-10,15,18H,3-5H2;1-4,6,8,10-11,15,17H,5,7,9H2;2*1H3,(H,3,4);;;/q;;;;;;;;;;-1;+1
• InChIKey: PLCYNYUBDMMPPP-UHFFFAOYSA-N
• XLogP: 32.06
• TPSA: 393.88 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 19
• Rotatable Bonds: 12
• Heavy Atoms: 179
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2661.65
LogP ≤ 5	32.06
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide?

The IUPAC name of acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide (CID 159585239) is acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide.

What is the SMILES notation for acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide?

The canonical SMILES for acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide is Brc1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.CC(=O)O.CC(=O)O.CC(=O)n1c2c(c3cc(Br)ccc31)CCCC2n1cccc1.COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.O=C(O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.[C-]#N.[C-]#[N+]c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.[Cu+].[Pd].c1ccc2c3c([nH]c2c1)C(n1cccc1)CCC3.c1ccn(C2CCCc3c2[nH]c2ccc(N4CCOCC4)cc32)c1.

What is the InChIKey of acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide?

The InChIKey is PLCYNYUBDMMPPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O.C18H17BrN2O.C18H18N2O2.C17H17N3O.C17H15N3.C17H16N2O2.C16H15BrN2.C16H16N2.2C2H4O2.CN.Cu.Pd/c1-2-9-23(8-1)19-5-3-4-16-17-14-15(22-10-12-24-13-11-22)6-7-18(17)21-20(16)19;1-12(22)21-16-8-7-13(19)11-15(16)14-5-4-6-17(18(14)21)20-9-2-3-10-20;1-22-18(21)12-7-8-15-14(11-12)13-5-4-6-16(17(13)19-15)20-9-2-3-10-20;18-17(21)11-6-7-14-13(10-11)12-4-3-5-15(16(12)19-14)20-8-1-2-9-20;1-18-12-7-8-15-14(11-12)13-5-4-6-16(17(13)19-15)20-9-2-3-10-20;20-17(21)11-6-7-14-13(10-11)12-4-3-5-15(16(12)18-14)19-8-1-2-9-19;17-11-6-7-14-13(10-11)12-4-3-5-15(16(12)18-14)19-8-1-2-9-19;1-2-8-14-12(6-1)13-7-5-9-15(16(13)17-14)18-10-3-4-11-18;2*1-2(3)4;1-2;;/h1-2,6-9,14,19,21H,3-5,10-13H2;2-3,7-11,17H,4-6H2,1H3;2-3,7-11,16,19H,4-6H2,1H3;1-2,6-10,15,19H,3-5H2,(H2,18,21);2-3,7-11,16,19H,4-6H2;1-2,6-10,15,18H,3-5H2,(H,20,21);1-2,6-10,15,18H,3-5H2;1-4,6,8,10-11,15,17H,5,7,9H2;2*1H3,(H,3,4);;;/q;;;;;;;;;;-1;+1;.

What are the key properties of acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide?

acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide has a molecular weight of 2661.65 g/mol, XLogP of 32.06, 12 rotatable bonds, 11 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for acetic acid;6-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;1-(6-bromo-1-pyrrol-1-yl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanone;copper(1+);6-isocyano-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;methyl 8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate;palladium;1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide;8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid;4-(8-pyrrol-1-yl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)morpholine;cyanide is sourced from PubChem (CID 159585239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).