3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride

C183H209BrClN27O13 — CID 167550644

About 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride

3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride (PubChem CID 167550644) has the molecular formula C183H209BrClN27O13 and a molecular weight of 3110.22 g/mol. Its IUPAC name is 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride.

Molecular Properties

• Compound Name: 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride
• PubChem CID: 167550644
• Molecular Formula: C183H209BrClN27O13
• Molecular Weight: 3110.22 g/mol
• Exact Mass: 3106.54
• IUPAC Name: 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride
• SMILES: Cl.O=C1CCC(Br)C(=O)N1.O=C1CCC(N2C(=O)c3cccc4c(Cc5cnn(C6CCN([C@@H]7CCCC78CCC8)CC6)c5)ccc2c34)C(=O)N1.O=C1CCC(N2C(=O)c3cccc4c(Cc5cnn(C6CCN([C@H]7CCCC78CCC8)CC6)c5)ccc2c34)C(=O)N1.O=C1CCCC12CCC2.O=C1Nc2ccc(Cc3cnn(C4CCN(C5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCN([C@@H]5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCN([C@H]5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCNCC4)c3)c3cccc1c23
• InChI: InChI=1S/2C33H37N5O3.3C28H32N4O.C20H20N4O.C8H12O.C5H6BrNO2.ClH/c2*39-29-10-9-27(31(40)35-29)38-26-8-7-22(24-4-1-5-25(30(24)26)32(38)41)18-21-19-34-37(20-21)23-11-16-36(17-12-23)28-6-2-13-33(28)14-3-15-33;3*33-27-23-5-1-4-22-20(7-8-24(30-27)26(22)23)16-19-17-29-32(18-19)21-9-14-31(15-10-21)25-6-2-11-28(25)12-3-13-28;25-20-17-3-1-2-16-14(4-5-18(23-20)19(16)17)10-13-11-22-24(12-13)15-6-8-21-9-7-15;9-7-3-1-4-8(7)5-2-6-8;6-3-1-2-4(8)7-5(3)9;/h2*1,4-5,7-8,19-20,23,27-28H,2-3,6,9-18H2,(H,35,39,40);3*1,4-5,7-8,17-18,21,25H,2-3,6,9-16H2,(H,30,33);1-5,11-12,15,21H,6-10H2,(H,23,25);1-6H2;3H,1-2H2,(H,7,8,9);1H/t2*27?,28-;2*25-;;;;;/m1010...../s1
• InChIKey: XPMDRQZQRHLGFS-QATGQGMWSA-N
• XLogP: 31.80
• TPSA: 447.75 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 31
• Rotatable Bonds: 25
• Heavy Atoms: 225
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3110.22
LogP ≤ 5	31.80
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride?

The IUPAC name of 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride (CID 167550644) is 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride.

What is the SMILES notation for 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride?

The canonical SMILES for 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride is Cl.O=C1CCC(Br)C(=O)N1.O=C1CCC(N2C(=O)c3cccc4c(Cc5cnn(C6CCN([C@@H]7CCCC78CCC8)CC6)c5)ccc2c34)C(=O)N1.O=C1CCC(N2C(=O)c3cccc4c(Cc5cnn(C6CCN([C@H]7CCCC78CCC8)CC6)c5)ccc2c34)C(=O)N1.O=C1CCCC12CCC2.O=C1Nc2ccc(Cc3cnn(C4CCN(C5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCN([C@@H]5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCN([C@H]5CCCC56CCC6)CC4)c3)c3cccc1c23.O=C1Nc2ccc(Cc3cnn(C4CCNCC4)c3)c3cccc1c23.

What is the InChIKey of 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride?

The InChIKey is XPMDRQZQRHLGFS-QATGQGMWSA-N. The full InChI is InChI=1S/2C33H37N5O3.3C28H32N4O.C20H20N4O.C8H12O.C5H6BrNO2.ClH/c2*39-29-10-9-27(31(40)35-29)38-26-8-7-22(24-4-1-5-25(30(24)26)32(38)41)18-21-19-34-37(20-21)23-11-16-36(17-12-23)28-6-2-13-33(28)14-3-15-33;3*33-27-23-5-1-4-22-20(7-8-24(30-27)26(22)23)16-19-17-29-32(18-19)21-9-14-31(15-10-21)25-6-2-11-28(25)12-3-13-28;25-20-17-3-1-2-16-14(4-5-18(23-20)19(16)17)10-13-11-22-24(12-13)15-6-8-21-9-7-15;9-7-3-1-4-8(7)5-2-6-8;6-3-1-2-4(8)7-5(3)9;/h2*1,4-5,7-8,19-20,23,27-28H,2-3,6,9-18H2,(H,35,39,40);3*1,4-5,7-8,17-18,21,25H,2-3,6,9-16H2,(H,30,33);1-5,11-12,15,21H,6-10H2,(H,23,25);1-6H2;3H,1-2H2,(H,7,8,9);1H/t2*27?,28-;2*25-;;;;;/m1010...../s1.

What are the key properties of 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride?

3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride has a molecular weight of 3110.22 g/mol, XLogP of 31.80, 25 rotatable bonds, 8 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 3-bromopiperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;3-[2-oxo-6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]benzo[cd]indol-1-yl]piperidine-2,6-dione;6-[(1-piperidin-4-ylpyrazol-4-yl)methyl]-1H-benzo[cd]indol-2-one;spiro[3.4]octan-8-one;6-[[1-(1-spiro[3.4]octan-8-ylpiperidin-4-yl)pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8S)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;6-[[1-[1-[(8R)-spiro[3.4]octan-8-yl]piperidin-4-yl]pyrazol-4-yl]methyl]-1H-benzo[cd]indol-2-one;hydrochloride is sourced from PubChem (CID 167550644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).