N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid

C175H204B3Cl2F12N23O39S3 — CID 159948078

About N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid

N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid (PubChem CID 159948078) has the molecular formula C175H204B3Cl2F12N23O39S3 and a molecular weight of 3681.20 g/mol. Its IUPAC name is N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid.

Molecular Properties

• Compound Name: N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid
• PubChem CID: 159948078
• Molecular Formula: C175H204B3Cl2F12N23O39S3
• Molecular Weight: 3681.20 g/mol
• Exact Mass: 3678.33
• IUPAC Name: N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid
• SMILES: C.C=CC(=O)Cl.C=CC(=O)N1CCC(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)C1.CC(C)(C)OC(=O)N1CC=C(OS(=O)(=O)C(F)(F)F)C1.CC(C)(C)OC(=O)N1CC=C(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC(C)(C)OC(=O)N1CCC(=O)C1.CC(C)(C)OC(=O)N1CCC(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CO.FC(F)(F)N(c1ccccc1)C(F)(F)F.NC(=O)c1cnc(C2CCNC2)nc1-c1ccc(Oc2ccccc2)cc1.NC(=O)c1cnc(Cl)nc1-c1ccc(Oc2ccccc2)cc1.O=C(O)C(F)(F)F.O=S=O.O=S=O
• InChI: InChI=1S/C26H28N4O4.C26H26N4O4.C24H22N4O3.C21H20N4O2.C17H12ClN3O2.C15H26BNO4.C12H24B2O4.C10H14F3NO5S.C9H15NO3.C8H5F6N.C3H3ClO.C2HF3O2.CH4O.CH4.2O2S/c2*1-26(2,3)34-25(32)30-14-13-18(16-30)24-28-15-21(23(27)31)22(29-24)17-9-11-20(12-10-17)33-19-7-5-4-6-8-19;1-2-21(29)28-13-12-17(15-28)24-26-14-20(23(25)30)22(27-24)16-8-10-19(11-9-16)31-18-6-4-3-5-7-18;22-20(26)18-13-24-21(15-10-11-23-12-15)25-19(18)14-6-8-17(9-7-14)27-16-4-2-1-3-5-16;18-17-20-10-14(16(19)22)15(21-17)11-6-8-13(9-7-11)23-12-4-2-1-3-5-12;1-13(2,3)19-12(18)17-9-8-11(10-17)16-20-14(4,5)15(6,7)21-16;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-9(2,3)18-8(15)14-5-4-7(6-14)19-20(16,17)10(11,12)13;1-9(2,3)13-8(12)10-5-4-7(11)6-10;9-7(10,11)15(8(12,13)14)6-4-2-1-3-5-6;1-2-3(4)5;3-2(4,5)1(6)7;1-2;;2*1-3-2/h4-12,15,18H,13-14,16H2,1-3H3,(H2,27,31);4-13,15H,14,16H2,1-3H3,(H2,27,31);2-11,14,17H,1,12-13,15H2,(H2,25,30);1-9,13,15,23H,10-12H2,(H2,22,26);1-10H,(H2,19,22);8H,9-10H2,1-7H3;1-8H3;4H,5-6H2,1-3H3;4-6H2,1-3H3;1-5H;2H,1H2;(H,6,7);2H,1H3;1H4
• InChIKey: SOGJWQZPXIVJJY-UHFFFAOYSA-N
• XLogP: 32.00
• TPSA: 832.48 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 50
• Rotatable Bonds: 31
• Heavy Atoms: 257
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3681.20
LogP ≤ 5	32.00
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid?

The IUPAC name of N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid (CID 159948078) is N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid.

What is the SMILES notation for N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid?

The canonical SMILES for N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid is C.C=CC(=O)Cl.C=CC(=O)N1CCC(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC(C)(C)OC(=O)N1CC=C(B2OC(C)(C)C(C)(C)O2)C1.CC(C)(C)OC(=O)N1CC=C(OS(=O)(=O)C(F)(F)F)C1.CC(C)(C)OC(=O)N1CC=C(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC(C)(C)OC(=O)N1CCC(=O)C1.CC(C)(C)OC(=O)N1CCC(c2ncc(C(N)=O)c(-c3ccc(Oc4ccccc4)cc3)n2)C1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CO.FC(F)(F)N(c1ccccc1)C(F)(F)F.NC(=O)c1cnc(C2CCNC2)nc1-c1ccc(Oc2ccccc2)cc1.NC(=O)c1cnc(Cl)nc1-c1ccc(Oc2ccccc2)cc1.O=C(O)C(F)(F)F.O=S=O.O=S=O.

What is the InChIKey of N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid?

The InChIKey is SOGJWQZPXIVJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N4O4.C26H26N4O4.C24H22N4O3.C21H20N4O2.C17H12ClN3O2.C15H26BNO4.C12H24B2O4.C10H14F3NO5S.C9H15NO3.C8H5F6N.C3H3ClO.C2HF3O2.CH4O.CH4.2O2S/c2*1-26(2,3)34-25(32)30-14-13-18(16-30)24-28-15-21(23(27)31)22(29-24)17-9-11-20(12-10-17)33-19-7-5-4-6-8-19;1-2-21(29)28-13-12-17(15-28)24-26-14-20(23(25)30)22(27-24)16-8-10-19(11-9-16)31-18-6-4-3-5-7-18;22-20(26)18-13-24-21(15-10-11-23-12-15)25-19(18)14-6-8-17(9-7-14)27-16-4-2-1-3-5-16;18-17-20-10-14(16(19)22)15(21-17)11-6-8-13(9-7-11)23-12-4-2-1-3-5-12;1-13(2,3)19-12(18)17-9-8-11(10-17)16-20-14(4,5)15(6,7)21-16;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-9(2,3)18-8(15)14-5-4-7(6-14)19-20(16,17)10(11,12)13;1-9(2,3)13-8(12)10-5-4-7(11)6-10;9-7(10,11)15(8(12,13)14)6-4-2-1-3-5-6;1-2-3(4)5;3-2(4,5)1(6)7;1-2;;2*1-3-2/h4-12,15,18H,13-14,16H2,1-3H3,(H2,27,31);4-13,15H,14,16H2,1-3H3,(H2,27,31);2-11,14,17H,1,12-13,15H2,(H2,25,30);1-9,13,15,23H,10-12H2,(H2,22,26);1-10H,(H2,19,22);8H,9-10H2,1-7H3;1-8H3;4H,5-6H2,1-3H3;4-6H2,1-3H3;1-5H;2H,1H2;(H,6,7);2H,1H3;1H4;;.

What are the key properties of N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid?

N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid has a molecular weight of 3681.20 g/mol, XLogP of 32.00, 31 rotatable bonds, 8 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-bis(trifluoromethyl)aniline;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-[5-carbamoyl-4-(4-phenoxyphenyl)pyrimidin-2-yl]pyrrolidine-1-carboxylate;tert-butyl 3-oxopyrrolidine-1-carboxylate;tert-butyl 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,5-dihydropyrrole-1-carboxylate;tert-butyl 3-(trifluoromethylsulfonyloxy)-2,5-dihydropyrrole-1-carboxylate;2-chloro-4-(4-phenoxyphenyl)pyrimidine-5-carboxamide;methane;methanol;4-(4-phenoxyphenyl)-2-(1-prop-2-enoylpyrrolidin-3-yl)pyrimidine-5-carboxamide;4-(4-phenoxyphenyl)-2-pyrrolidin-3-ylpyrimidine-5-carboxamide;prop-2-enoyl chloride;bis(sulfur dioxide);4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 159948078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).