6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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

C107H106Br4N14O7 — CID 158038221

About 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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

6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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 (PubChem CID 158038221) has the molecular formula C107H106Br4N14O7 and a molecular weight of 2019.73 g/mol. Its IUPAC name is 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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.

Molecular Properties

• Compound Name: 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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
• PubChem CID: 158038221
• Molecular Formula: C107H106Br4N14O7
• Molecular Weight: 2019.73 g/mol
• Exact Mass: 2014.51
• IUPAC Name: 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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
• SMILES: Brc1ccc2[nH]c3c(c2c1)CCCC3NCCN1CCCCC1.Brc1ccc2c3c([nH]c2c1)C(n1cccc1)CCC3.NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1cc2ccccc2o1.O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1ccco1.O=C(O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1
• InChI: InChI=1S/C21H17BrN2O2.C19H26BrN3.C17H15BrN2O2.C17H17N3O.C17H16N2O2.C16H15BrN2/c22-13-8-9-16-15(11-13)14-5-3-6-17(20(14)23-16)24-21(25)19-10-12-4-1-2-7-18(12)26-19;20-14-7-8-17-16(13-14)15-5-4-6-18(19(15)22-17)21-9-12-23-10-2-1-3-11-23;18-10-6-7-13-12(9-10)11-3-1-4-14(16(11)19-13)20-17(21)15-5-2-8-22-15;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;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;17-11-6-7-12-13-4-3-5-15(19-8-1-2-9-19)16(13)18-14(12)10-11/h1-2,4,7-11,17,23H,3,5-6H2,(H,24,25);7-8,13,18,21-22H,1-6,9-12H2;2,5-9,14,19H,1,3-4H2,(H,20,21);1-2,6-10,15,19H,3-5H2,(H2,18,21);1-2,6-10,15,18H,3-5H2,(H,20,21);1-2,6-10,15,18H,3-5H2
• InChIKey: FIALBTLMQMCJOO-UHFFFAOYSA-N
• XLogP: 25.44
• TPSA: 289.67 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 11
• Rotatable Bonds: 13
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2019.73
LogP ≤ 5	25.44
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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?

The IUPAC name of 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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 (CID 158038221) is 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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.

What is the SMILES notation for 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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?

The canonical SMILES for 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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 is Brc1ccc2[nH]c3c(c2c1)CCCC3NCCN1CCCCC1.Brc1ccc2c3c([nH]c2c1)C(n1cccc1)CCC3.NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1cc2ccccc2o1.O=C(NC1CCCc2c1[nH]c1ccc(Br)cc21)c1ccco1.O=C(O)c1ccc2[nH]c3c(c2c1)CCCC3n1cccc1.

What is the InChIKey of 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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?

The InChIKey is FIALBTLMQMCJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17BrN2O2.C19H26BrN3.C17H15BrN2O2.C17H17N3O.C17H16N2O2.C16H15BrN2/c22-13-8-9-16-15(11-13)14-5-3-6-17(20(14)23-16)24-21(25)19-10-12-4-1-2-7-18(12)26-19;20-14-7-8-17-16(13-14)15-5-4-6-18(19(15)22-17)21-9-12-23-10-2-1-3-11-23;18-10-6-7-13-12(9-10)11-3-1-4-14(16(11)19-13)20-17(21)15-5-2-8-22-15;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;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;17-11-6-7-12-13-4-3-5-15(19-8-1-2-9-19)16(13)18-14(12)10-11/h1-2,4,7-11,17,23H,3,5-6H2,(H,24,25);7-8,13,18,21-22H,1-6,9-12H2;2,5-9,14,19H,1,3-4H2,(H,20,21);1-2,6-10,15,19H,3-5H2,(H2,18,21);1-2,6-10,15,18H,3-5H2,(H,20,21);1-2,6-10,15,18H,3-5H2.

What are the key properties of 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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?

6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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 has a molecular weight of 2019.73 g/mol, XLogP of 25.44, 13 rotatable bonds, 11 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 6-bromo-N-(2-piperidin-1-ylethyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine;7-bromo-1-pyrrol-1-yl-2,3,4,9-tetrahydro-1H-carbazole;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-1-benzofuran-2-carboxamide;N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)furan-2-carboxamide;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 is sourced from PubChem (CID 158038221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).