tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole

C96H107F3N8O15S — CID 158357526

About tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole

tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole (PubChem CID 158357526) has the molecular formula C96H107F3N8O15S and a molecular weight of 1702.01 g/mol. Its IUPAC name is tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole.

Molecular Properties

• Compound Name: tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole
• PubChem CID: 158357526
• Molecular Formula: C96H107F3N8O15S
• Molecular Weight: 1702.01 g/mol
• Exact Mass: 1700.75
• IUPAC Name: tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole
• SMILES: CC(C)(C)OC(=O)N1CC(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(O)C(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)N1CC(O)C(O)C(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)N1CC=CC(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)OC1C=CCCC1.c1ccc2c(c1)[nH]c1ccccc12
• InChI: InChI=1S/C29H30F3N3O6S.C22H26N2O4.C22H24N2O2.C12H9N.C11H18O3/c1-28(2,3)41-27(37)34-16-22(33-42(38,39)19-14-12-18(13-15-19)40-29(30,31)32)26(36)25(17-34)35-23-10-6-4-8-20(23)21-9-5-7-11-24(21)35;1-22(2,3)28-21(27)23-12-18(20(26)19(25)13-23)24-16-10-6-4-8-14(16)15-9-5-7-11-17(15)24;1-22(2,3)26-21(25)23-14-8-9-16(15-23)24-19-12-6-4-10-17(19)18-11-5-7-13-20(18)24;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-11(2,3)14-10(12)13-9-7-5-4-6-8-9/h4-15,22,25-26,33,36H,16-17H2,1-3H3;4-11,18-20,25-26H,12-13H2,1-3H3;4-13,16H,14-15H2,1-3H3;1-8,13H;5,7,9H,4,6,8H2,1-3H3
• InChIKey: GTBHAFISZOBNJG-UHFFFAOYSA-N
• XLogP: 20.01
• TPSA: 270.82 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 18
• Rotatable Bonds: 8
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1702.01
LogP ≤ 5	20.01
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole?

The IUPAC name of tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole (CID 158357526) is tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole.

What is the SMILES notation for tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole?

The canonical SMILES for tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole is CC(C)(C)OC(=O)N1CC(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C(O)C(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)N1CC(O)C(O)C(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)N1CC=CC(n2c3ccccc3c3ccccc32)C1.CC(C)(C)OC(=O)OC1C=CCCC1.c1ccc2c(c1)[nH]c1ccccc12.

What is the InChIKey of tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole?

The InChIKey is GTBHAFISZOBNJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30F3N3O6S.C22H26N2O4.C22H24N2O2.C12H9N.C11H18O3/c1-28(2,3)41-27(37)34-16-22(33-42(38,39)19-14-12-18(13-15-19)40-29(30,31)32)26(36)25(17-34)35-23-10-6-4-8-20(23)21-9-5-7-11-24(21)35;1-22(2,3)28-21(27)23-12-18(20(26)19(25)13-23)24-16-10-6-4-8-14(16)15-9-5-7-11-17(15)24;1-22(2,3)26-21(25)23-14-8-9-16(15-23)24-19-12-6-4-10-17(19)18-11-5-7-13-20(18)24;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-11(2,3)14-10(12)13-9-7-5-4-6-8-9/h4-15,22,25-26,33,36H,16-17H2,1-3H3;4-11,18-20,25-26H,12-13H2,1-3H3;4-13,16H,14-15H2,1-3H3;1-8,13H;5,7,9H,4,6,8H2,1-3H3.

What are the key properties of tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole?

tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole has a molecular weight of 1702.01 g/mol, XLogP of 20.01, 8 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 3-carbazol-9-yl-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4,5-dihydroxypiperidine-1-carboxylate;tert-butyl 3-carbazol-9-yl-4-hydroxy-5-[[4-(trifluoromethoxy)phenyl]sulfonylamino]piperidine-1-carboxylate;tert-butyl cyclohex-2-en-1-yl carbonate;9H-carbazole is sourced from PubChem (CID 158357526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).