bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine

C86H111BCl6F3N13O16 — CID 164996406

About bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine

bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine (PubChem CID 164996406) has the molecular formula C86H111BCl6F3N13O16 and a molecular weight of 1863.43 g/mol. Its IUPAC name is bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine.

Molecular Properties

• Compound Name: bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine
• PubChem CID: 164996406
• Molecular Formula: C86H111BCl6F3N13O16
• Molecular Weight: 1863.43 g/mol
• Exact Mass: 1859.64
• IUPAC Name: bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine
• SMILES: C1COCCN1.CC(C)(O)c1cc(Cl)cc(N2CCOCC2)n1.CC[C@@H]1CCN(C(=O)Nc2ccc(C)c(-c3cc(N4CCOCC4)nc(C(C)(C)O)c3)c2)C1.Cc1cc(Cl)cc(Cl)n1.Cc1cc(Cl)cc(N2CCOCC2)n1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1B1OC(C)(C)C(C)(C)O1.O=C=O.O=C=O.O=COc1cc(Cl)cc(Cl)n1
• InChI: InChI=1S/C26H36N4O3.C20H28BF3N2O3.C12H17ClN2O2.C10H13ClN2O.C6H3Cl2NO2.C6H5Cl2N.C4H9NO.2CO2/c1-5-19-8-9-30(17-19)25(31)27-21-7-6-18(2)22(16-21)20-14-23(26(3,4)32)28-24(15-20)29-10-12-33-13-11-29;1-13-6-7-15(10-16(13)21-28-18(2,3)19(4,5)29-21)25-17(27)26-9-8-14(12-26)11-20(22,23)24;1-12(2,16)10-7-9(13)8-11(14-10)15-3-5-17-6-4-15;1-8-6-9(11)7-10(12-8)13-2-4-14-5-3-13;7-4-1-5(8)9-6(2-4)11-3-10;1-4-2-5(7)3-6(8)9-4;1-3-6-4-2-5-1;2*2-1-3/h6-7,14-16,19,32H,5,8-13,17H2,1-4H3,(H,27,31);6-7,10,14H,8-9,11-12H2,1-5H3,(H,25,27);7-8,16H,3-6H2,1-2H3;6-7H,2-5H2,1H3;1-3H;2-3H,1H3;5H,1-4H2;;/t19-;14-;;;;;;;/m10......./s1
• InChIKey: HPSSKNYNGUYXAI-OAYRDHAZSA-N
• XLogP: 15.22
• TPSA: 341.30 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 25
• Rotatable Bonds: 13
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1863.43
LogP ≤ 5	15.22
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine?

The IUPAC name of bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine (CID 164996406) is bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine.

What is the SMILES notation for bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine?

The canonical SMILES for bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine is C1COCCN1.CC(C)(O)c1cc(Cl)cc(N2CCOCC2)n1.CC[C@@H]1CCN(C(=O)Nc2ccc(C)c(-c3cc(N4CCOCC4)nc(C(C)(C)O)c3)c2)C1.Cc1cc(Cl)cc(Cl)n1.Cc1cc(Cl)cc(N2CCOCC2)n1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1B1OC(C)(C)C(C)(C)O1.O=C=O.O=C=O.O=COc1cc(Cl)cc(Cl)n1.

What is the InChIKey of bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine?

The InChIKey is HPSSKNYNGUYXAI-OAYRDHAZSA-N. The full InChI is InChI=1S/C26H36N4O3.C20H28BF3N2O3.C12H17ClN2O2.C10H13ClN2O.C6H3Cl2NO2.C6H5Cl2N.C4H9NO.2CO2/c1-5-19-8-9-30(17-19)25(31)27-21-7-6-18(2)22(16-21)20-14-23(26(3,4)32)28-24(15-20)29-10-12-33-13-11-29;1-13-6-7-15(10-16(13)21-28-18(2,3)19(4,5)29-21)25-17(27)26-9-8-14(12-26)11-20(22,23)24;1-12(2,16)10-7-9(13)8-11(14-10)15-3-5-17-6-4-15;1-8-6-9(11)7-10(12-8)13-2-4-14-5-3-13;7-4-1-5(8)9-6(2-4)11-3-10;1-4-2-5(7)3-6(8)9-4;1-3-6-4-2-5-1;2*2-1-3/h6-7,14-16,19,32H,5,8-13,17H2,1-4H3,(H,27,31);6-7,10,14H,8-9,11-12H2,1-5H3,(H,25,27);7-8,16H,3-6H2,1-2H3;6-7H,2-5H2,1H3;1-3H;2-3H,1H3;5H,1-4H2;;/t19-;14-;;;;;;;/m10......./s1.

What are the key properties of bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine?

bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine has a molecular weight of 1863.43 g/mol, XLogP of 15.22, 13 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for bis(carbon dioxide);4-(4-chloro-6-methyl-2-pyridinyl)morpholine;2-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propan-2-ol;2,4-dichloro-6-methylpyridine;(4,6-dichloro-2-pyridinyl) formate;(3R)-3-ethyl-N-[3-[2-(2-hydroxypropan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-4-methylphenyl]pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;morpholine is sourced from PubChem (CID 164996406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).