8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one

C117H118Br4FN15O11 — CID 163439365

About 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one

8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one (PubChem CID 163439365) has the molecular formula C117H118Br4FN15O11 and a molecular weight of 2248.94 g/mol. Its IUPAC name is 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one.

Molecular Properties

• Compound Name: 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one
• PubChem CID: 163439365
• Molecular Formula: C117H118Br4FN15O11
• Molecular Weight: 2248.94 g/mol
• Exact Mass: 2243.59
• IUPAC Name: 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one
• SMILES: CC1CCC2(CC1)C(=O)N(C)c1cnc3ccc(-c4ccc(F)nc4)cc3c12.CC1CCC2(CC1)C(=O)N(C)c1cnc3ccc(Br)cc3c12.CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)C2(CCC(O)CC2)C(=O)N4C)cn1.CN1C(=O)C2(CCC(O)CC2)c2c1cnc1ccc(Br)cc21.O=C1CCC2(CC1)C(=O)Nc1cnc3ccc(Br)cc3c12.O=C1Nc2cnc3ccc(Br)cc3c2C12CCC(O)CC2
• InChI: InChI=1S/C27H32N4O3.C23H22FN3O.C18H19BrN2O.C17H17BrN2O2.C16H15BrN2O2.C16H13BrN2O2/c1-30(2)13-4-14-34-24-8-6-19(16-29-24)18-5-7-22-21(15-18)25-23(17-28-22)31(3)26(33)27(25)11-9-20(32)10-12-27;1-14-7-9-23(10-8-14)21-17-11-15(16-4-6-20(24)26-12-16)3-5-18(17)25-13-19(21)27(2)22(23)28;1-11-5-7-18(8-6-11)16-13-9-12(19)3-4-14(13)20-10-15(16)21(2)17(18)22;1-20-14-9-19-13-3-2-10(18)8-12(13)15(14)17(16(20)22)6-4-11(21)5-7-17;2*17-9-1-2-12-11(7-9)14-13(8-18-12)19-15(21)16(14)5-3-10(20)4-6-16/h5-8,15-17,20,32H,4,9-14H2,1-3H3;3-6,11-14H,7-10H2,1-2H3;3-4,9-11H,5-8H2,1-2H3;2-3,8-9,11,21H,4-7H2,1H3;1-2,7-8,10,20H,3-6H2,(H,19,21);1-2,7-8H,3-6H2,(H,19,21)
• InChIKey: AXEWUGJCCSJTIH-UHFFFAOYSA-N
• XLogP: 22.66
• TPSA: 332.79 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 7
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2248.94
LogP ≤ 5	22.66
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one?

The IUPAC name of 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one (CID 163439365) is 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one.

What is the SMILES notation for 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one?

The canonical SMILES for 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one is CC1CCC2(CC1)C(=O)N(C)c1cnc3ccc(-c4ccc(F)nc4)cc3c12.CC1CCC2(CC1)C(=O)N(C)c1cnc3ccc(Br)cc3c12.CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)C2(CCC(O)CC2)C(=O)N4C)cn1.CN1C(=O)C2(CCC(O)CC2)c2c1cnc1ccc(Br)cc21.O=C1CCC2(CC1)C(=O)Nc1cnc3ccc(Br)cc3c12.O=C1Nc2cnc3ccc(Br)cc3c2C12CCC(O)CC2.

What is the InChIKey of 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one?

The InChIKey is AXEWUGJCCSJTIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N4O3.C23H22FN3O.C18H19BrN2O.C17H17BrN2O2.C16H15BrN2O2.C16H13BrN2O2/c1-30(2)13-4-14-34-24-8-6-19(16-29-24)18-5-7-22-21(15-18)25-23(17-28-22)31(3)26(33)27(25)11-9-20(32)10-12-27;1-14-7-9-23(10-8-14)21-17-11-15(16-4-6-20(24)26-12-16)3-5-18(17)25-13-19(21)27(2)22(23)28;1-11-5-7-18(8-6-11)16-13-9-12(19)3-4-14(13)20-10-15(16)21(2)17(18)22;1-20-14-9-19-13-3-2-10(18)8-12(13)15(14)17(16(20)22)6-4-11(21)5-7-17;2*17-9-1-2-12-11(7-9)14-13(8-18-12)19-15(21)16(14)5-3-10(20)4-6-16/h5-8,15-17,20,32H,4,9-14H2,1-3H3;3-6,11-14H,7-10H2,1-2H3;3-4,9-11H,5-8H2,1-2H3;2-3,8-9,11,21H,4-7H2,1H3;1-2,7-8,10,20H,3-6H2,(H,19,21);1-2,7-8H,3-6H2,(H,19,21).

What are the key properties of 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one?

8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one has a molecular weight of 2248.94 g/mol, XLogP of 22.66, 7 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 8'-bromo-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-bromo-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8-bromo-4'-hydroxyspiro[3H-pyrrolo[2,3-c]quinoline-1,1'-cyclohexane]-2-one;8-bromospiro[3H-pyrrolo[2,3-c]quinoline-1,4'-cyclohexane]-1',2-dione;8'-[6-[3-(dimethylamino)propoxy]-3-pyridinyl]-4-hydroxy-3'-methylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one;8'-(6-fluoro-3-pyridinyl)-3',4-dimethylspiro[cyclohexane-1,1'-pyrrolo[2,3-c]quinoline]-2'-one is sourced from PubChem (CID 163439365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).