4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane

C137H166ClF16N11O15S — CID 158103454

About 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane

4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane (PubChem CID 158103454) has the molecular formula C137H166ClF16N11O15S and a molecular weight of 2578.38 g/mol. Its IUPAC name is 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane.

Molecular Properties

• Compound Name: 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane
• PubChem CID: 158103454
• Molecular Formula: C137H166ClF16N11O15S
• Molecular Weight: 2578.38 g/mol
• Exact Mass: 2576.17
• IUPAC Name: 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane
• SMILES: C.C.C.C.C.CC(NC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccccc1)C(=O)O.CC(NC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccccc1)C(=O)OC(C)(C)C.CNC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccc(O)cc1.CNC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccc(OS(C)(=O)=O)cc1.NC[C@@H]1CC[C@@H]2[C@@H](c3ccccc3)Nc3ccc(C(F)(F)F)cc3[C@@H]2O1.OCC1CCC2C(c3ccccc3)Nc3ccc(Cl)c(F)c3C2O1
• InChI: InChI=1S/C27H33F3N2O3.C23H25F3N2O3.C22H25F3N2O4S.C21H23F3N2O2.C20H21F3N2O.C19H19ClFNO2.5CH4/c1-16(25(33)35-26(2,3)4)31-15-19-11-12-20-23(17-8-6-5-7-9-17)32-22-13-10-18(27(28,29)30)14-21(22)24(20)34-19;1-13(22(29)30)27-12-16-8-9-17-20(14-5-3-2-4-6-14)28-19-10-7-15(23(24,25)26)11-18(19)21(17)31-16;1-26-12-16-8-9-17-20(13-3-6-15(7-4-13)31-32(2,28)29)27-19-10-5-14(22(23,24)25)11-18(19)21(17)30-16;1-25-11-15-7-8-16-19(12-2-5-14(27)6-3-12)26-18-9-4-13(21(22,23)24)10-17(18)20(16)28-15;21-20(22,23)13-6-9-17-16(10-13)19-15(8-7-14(11-24)26-19)18(25-17)12-4-2-1-3-5-12;20-14-8-9-15-16(17(14)21)19-13(7-6-12(10-23)24-19)18(22-15)11-4-2-1-3-5-11;;;;;/h5-10,13-14,16,19-20,23-24,31-32H,11-12,15H2,1-4H3;2-7,10-11,13,16-17,20-21,27-28H,8-9,12H2,1H3,(H,29,30);3-7,10-11,16-17,20-21,26-27H,8-9,12H2,1-2H3;2-6,9-10,15-16,19-20,25-27H,7-8,11H2,1H3;1-6,9-10,14-15,18-19,25H,7-8,11,24H2;1-5,8-9,12-13,18-19,22-23H,6-7,10H2;5*1H4/t16?,19-,20+,23+,24+;13?,16-,17+,20+,21+;16-,17+,20+,21+;15-,16+,19+,20+;14-,15+,18+,19+;;;;;;/m11110....../s1
• InChIKey: FPNYQPGOCDUAMN-HGFSLXSRSA-N
• XLogP: 32.02
• TPSA: 349.13 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 25
• Rotatable Bonds: 22
• Heavy Atoms: 181
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2578.38
LogP ≤ 5	32.02
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane?

The IUPAC name of 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane (CID 158103454) is 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane.

What is the SMILES notation for 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane?

The canonical SMILES for 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane is C.C.C.C.C.CC(NC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccccc1)C(=O)O.CC(NC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccccc1)C(=O)OC(C)(C)C.CNC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccc(O)cc1.CNC[C@H]1CC[C@@H]2[C@H](O1)c1cc(C(F)(F)F)ccc1N[C@H]2c1ccc(OS(C)(=O)=O)cc1.NC[C@@H]1CC[C@@H]2[C@@H](c3ccccc3)Nc3ccc(C(F)(F)F)cc3[C@@H]2O1.OCC1CCC2C(c3ccccc3)Nc3ccc(Cl)c(F)c3C2O1.

What is the InChIKey of 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane?

The InChIKey is FPNYQPGOCDUAMN-HGFSLXSRSA-N. The full InChI is InChI=1S/C27H33F3N2O3.C23H25F3N2O3.C22H25F3N2O4S.C21H23F3N2O2.C20H21F3N2O.C19H19ClFNO2.5CH4/c1-16(25(33)35-26(2,3)4)31-15-19-11-12-20-23(17-8-6-5-7-9-17)32-22-13-10-18(27(28,29)30)14-21(22)24(20)34-19;1-13(22(29)30)27-12-16-8-9-17-20(14-5-3-2-4-6-14)28-19-10-7-15(23(24,25)26)11-18(19)21(17)31-16;1-26-12-16-8-9-17-20(13-3-6-15(7-4-13)31-32(2,28)29)27-19-10-5-14(22(23,24)25)11-18(19)21(17)30-16;1-25-11-15-7-8-16-19(12-2-5-14(27)6-3-12)26-18-9-4-13(21(22,23)24)10-17(18)20(16)28-15;21-20(22,23)13-6-9-17-16(10-13)19-15(8-7-14(11-24)26-19)18(25-17)12-4-2-1-3-5-12;20-14-8-9-15-16(17(14)21)19-13(7-6-12(10-23)24-19)18(22-15)11-4-2-1-3-5-11;;;;;/h5-10,13-14,16,19-20,23-24,31-32H,11-12,15H2,1-4H3;2-7,10-11,13,16-17,20-21,27-28H,8-9,12H2,1H3,(H,29,30);3-7,10-11,16-17,20-21,26-27H,8-9,12H2,1-2H3;2-6,9-10,15-16,19-20,25-27H,7-8,11H2,1H3;1-6,9-10,14-15,18-19,25H,7-8,11,24H2;1-5,8-9,12-13,18-19,22-23H,6-7,10H2;5*1H4/t16?,19-,20+,23+,24+;13?,16-,17+,20+,21+;16-,17+,20+,21+;15-,16+,19+,20+;14-,15+,18+,19+;;;;;;/m11110....../s1.

What are the key properties of 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane?

4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane has a molecular weight of 2578.38 g/mol, XLogP of 32.02, 22 rotatable bonds, 14 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenol;[4-[(2R,4aS,5R,10bS)-2-(methylaminomethyl)-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl]phenyl] methanesulfonate;[(2S,4aR,5S,10bR)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methanamine;2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoic acid;tert-butyl 2-[[(2R,4aS,5R,10bS)-5-phenyl-9-(trifluoromethyl)-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl]methylamino]propanoate;(9-chloro-10-fluoro-5-phenyl-3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-2-yl)methanol;methane is sourced from PubChem (CID 158103454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).