2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride

C166H215Cl7F5N33O24 — CID 158791223

About 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride

2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride (PubChem CID 158791223) has the molecular formula C166H215Cl7F5N33O24 and a molecular weight of 3399.91 g/mol. Its IUPAC name is 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride.

Molecular Properties

• Compound Name: 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride
• PubChem CID: 158791223
• Molecular Formula: C166H215Cl7F5N33O24
• Molecular Weight: 3399.91 g/mol
• Exact Mass: 3394.44
• IUPAC Name: 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride
• SMILES: C.C1CNC1.C1CN[C@@H](CN2CCC2)C1.C=CC(=O)Nc1cc(Nc2nccc(Nc3cc(Cl)c(F)cc3C(C)(C)O)n2)c(OC)cc1N1CCC[C@@H]1CN1CCC1.CC[C@H]1CCCN1C(=O)OCc1ccccc1.COc1cc(F)c([N+](=O)[O-])cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.COc1cc(N2CCC[C@@H]2CN2CCC2)c(N)cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.COc1cc(N2CCC[C@@H]2CN2CCC2)c([N+](=O)[O-])cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.Cl.O=C(Cl)CCCl.O=C(O)O.O=C(OCc1ccccc1)N1CCC[C@@H]1CN1CCC1.O=C(OCc1ccccc1)N1CCC[C@@H]1CO
• InChI: InChI=1S/C31H37ClFN7O3.C28H33ClFN7O4.C28H35ClFN7O2.C20H18ClF2N5O4.C16H22N2O2.C14H19NO2.C13H17NO3.C8H16N2.C3H4Cl2O.C3H7N.CH2O3.CH4.ClH/c1-5-29(41)36-24-16-25(27(43-4)17-26(24)40-13-6-8-19(40)18-39-11-7-12-39)37-30-34-10-9-28(38-30)35-23-15-21(32)22(33)14-20(23)31(2,3)42;1-28(2,38)18-12-20(30)19(29)13-21(18)32-26-7-8-31-27(34-26)33-22-14-24(37(39)40)23(15-25(22)41-3)36-11-4-6-17(36)16-35-9-5-10-35;1-28(2,38)18-12-20(30)19(29)13-22(18)33-26-7-8-32-27(35-26)34-23-14-21(31)24(15-25(23)39-3)37-11-4-6-17(37)16-36-9-5-10-36;1-20(2,29)10-6-12(22)11(21)7-14(10)25-18-4-5-24-19(27-18)26-15-9-16(28(30)31)13(23)8-17(15)32-3;19-16(20-13-14-6-2-1-3-7-14)18-11-4-8-15(18)12-17-9-5-10-17;1-2-13-9-6-10-15(13)14(16)17-11-12-7-4-3-5-8-12;15-9-12-7-4-8-14(12)13(16)17-10-11-5-2-1-3-6-11;1-3-8(9-4-1)7-10-5-2-6-10;4-2-1-3(5)6;1-2-4-3-1;2-1(3)4;;/h5,9-10,14-17,19,42H,1,6-8,11-13,18H2,2-4H3,(H,36,41)(H2,34,35,37,38);7-8,12-15,17,38H,4-6,9-11,16H2,1-3H3,(H2,31,32,33,34);7-8,12-15,17,38H,4-6,9-11,16,31H2,1-3H3,(H2,32,33,34,35);4-9,29H,1-3H3,(H2,24,25,26,27);1-3,6-7,15H,4-5,8-13H2;3-5,7-8,13H,2,6,9-11H2,1H3;1-3,5-6,12,15H,4,7-10H2;8-9H,1-7H2;1-2H2;4H,1-3H2;(H2,2,3,4);1H4;1H/t19-;2*17-;;15-;13-;12-;8-;;;;;/m111.1011...../s1
• InChIKey: WZPMEHIXUGSTOK-VNCYATOGSA-N
• XLogP: 32.21
• TPSA: 692.03 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 49
• Rotatable Bonds: 51
• Heavy Atoms: 235
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3399.91
LogP ≤ 5	32.21
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	49

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride?

The IUPAC name of 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride (CID 158791223) is 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride.

What is the SMILES notation for 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride?

The canonical SMILES for 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride is C.C1CNC1.C1CN[C@@H](CN2CCC2)C1.C=CC(=O)Nc1cc(Nc2nccc(Nc3cc(Cl)c(F)cc3C(C)(C)O)n2)c(OC)cc1N1CCC[C@@H]1CN1CCC1.CC[C@H]1CCCN1C(=O)OCc1ccccc1.COc1cc(F)c([N+](=O)[O-])cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.COc1cc(N2CCC[C@@H]2CN2CCC2)c(N)cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.COc1cc(N2CCC[C@@H]2CN2CCC2)c([N+](=O)[O-])cc1Nc1nccc(Nc2cc(Cl)c(F)cc2C(C)(C)O)n1.Cl.O=C(Cl)CCCl.O=C(O)O.O=C(OCc1ccccc1)N1CCC[C@@H]1CN1CCC1.O=C(OCc1ccccc1)N1CCC[C@@H]1CO.

What is the InChIKey of 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride?

The InChIKey is WZPMEHIXUGSTOK-VNCYATOGSA-N. The full InChI is InChI=1S/C31H37ClFN7O3.C28H33ClFN7O4.C28H35ClFN7O2.C20H18ClF2N5O4.C16H22N2O2.C14H19NO2.C13H17NO3.C8H16N2.C3H4Cl2O.C3H7N.CH2O3.CH4.ClH/c1-5-29(41)36-24-16-25(27(43-4)17-26(24)40-13-6-8-19(40)18-39-11-7-12-39)37-30-34-10-9-28(38-30)35-23-15-21(32)22(33)14-20(23)31(2,3)42;1-28(2,38)18-12-20(30)19(29)13-21(18)32-26-7-8-31-27(34-26)33-22-14-24(37(39)40)23(15-25(22)41-3)36-11-4-6-17(36)16-35-9-5-10-35;1-28(2,38)18-12-20(30)19(29)13-22(18)33-26-7-8-32-27(35-26)34-23-14-21(31)24(15-25(23)39-3)37-11-4-6-17(37)16-36-9-5-10-36;1-20(2,29)10-6-12(22)11(21)7-14(10)25-18-4-5-24-19(27-18)26-15-9-16(28(30)31)13(23)8-17(15)32-3;19-16(20-13-14-6-2-1-3-7-14)18-11-4-8-15(18)12-17-9-5-10-17;1-2-13-9-6-10-15(13)14(16)17-11-12-7-4-3-5-8-12;15-9-12-7-4-8-14(12)13(16)17-10-11-5-2-1-3-6-11;1-3-8(9-4-1)7-10-5-2-6-10;4-2-1-3(5)6;1-2-4-3-1;2-1(3)4;;/h5,9-10,14-17,19,42H,1,6-8,11-13,18H2,2-4H3,(H,36,41)(H2,34,35,37,38);7-8,12-15,17,38H,4-6,9-11,16H2,1-3H3,(H2,31,32,33,34);7-8,12-15,17,38H,4-6,9-11,16,31H2,1-3H3,(H2,32,33,34,35);4-9,29H,1-3H3,(H2,24,25,26,27);1-3,6-7,15H,4-5,8-13H2;3-5,7-8,13H,2,6,9-11H2,1H3;1-3,5-6,12,15H,4,7-10H2;8-9H,1-7H2;1-2H2;4H,1-3H2;(H2,2,3,4);1H4;1H/t19-;2*17-;;15-;13-;12-;8-;;;;;/m111.1011...../s1.

What are the key properties of 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride?

2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride has a molecular weight of 3399.91 g/mol, XLogP of 32.21, 51 rotatable bonds, 19 hydrogen bond donors, and 49 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[[2-[5-amino-4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxyanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;azetidine;(2R)-2-(azetidin-1-ylmethyl)pyrrolidine;N-[2-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-5-[[4-[5-chloro-4-fluoro-2-(2-hydroxypropan-2-yl)anilino]pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;2-[2-[[2-[4-[(2R)-2-(azetidin-1-ylmethyl)pyrrolidin-1-yl]-2-methoxy-5-nitroanilino]pyrimidin-4-yl]amino]-4-chloro-5-fluorophenyl]propan-2-ol;benzyl (2R)-2-(azetidin-1-ylmethyl)pyrrolidine-1-carboxylate;benzyl (2S)-2-ethylpyrrolidine-1-carboxylate;benzyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate;carbonic acid;2-[4-chloro-5-fluoro-2-[[2-(4-fluoro-2-methoxy-5-nitroanilino)pyrimidin-4-yl]amino]phenyl]propan-2-ol;3-chloropropanoyl chloride;methane;hydrochloride is sourced from PubChem (CID 158791223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).