tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride

C136H187Cl3F4N8O14 — CID 159789040

IUPACtert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride
SMILESC.CC(=O)N[C@@H](Cc1ccc(O)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H]1CO1.CC(C)c1cccc(C2(N)CCCCC2)c1.CC(C)c1cccc(C2(NC[C@@H](O)[C@H](Cc3ccc(OCc4ccccc4)c(F)c3)NC(=O)OC(C)(C)C)CCCCC2)c1.Cl.Cl.Cl.[H][H]
InChIInChI=1S/C37H49FN2O4.C34H43FN2O3.C27H37FN2O3.C22H26FNO4.C15H23N.CH4.3ClH.H2/c1-26(2)29-15-12-16-30(23-29)37(19-10-7-11-20-37)39-24-33(41)32(40-35(42)44-36(3,4)5)22-28-17-18-34(31(38)21-28)43-25-27-13-8-6-9-14-27;1-24(2)28-13-10-14-29(21-28)34(17-8-5-9-18-34)36-22-32(39)31(37-25(3)38)20-27-15-16-33(30(35)19-27)40-23-26-11-6-4-7-12-26;1-18(2)21-8-7-9-22(16-21)27(12-5-4-6-13-27)29-17-26(33)24(30-19(3)31)15-20-10-11-25(32)23(28)14-20;1-22(2,3)28-21(25)24-18(20-14-27-20)12-16-9-10-19(17(23)11-16)26-13-15-7-5-4-6-8-15;1-12(2)13-7-6-8-14(11-13)15(16)9-4-3-5-10-15;;;;;/h6,8-9,12-18,21,23,26,32-33,39,41H,7,10-11,19-20,22,24-25H2,1-5H3,(H,40,42);4,6-7,10-16,19,21,24,31-32,36,39H,5,8-9,17-18,20,22-23H2,1-3H3,(H,37,38);7-11,14,16,18,24,26,29,32-33H,4-6,12-13,15,17H2,1-3H3,(H,30,31);4-11,18,20H,12-14H2,1-3H3,(H,24,25);6-8,11-12H,3-5,9-10,16H2,1-2H3;1H4;4*1H/t32-,33+;31-,32+;24-,26+;18-,20+;;;;;;/m0000....../s1
InChIKeyDXXHODSVNLGJKC-RWXZVTFFSA-N
MW2340.38 g/mol
LogP28.99
Rot. Bonds42

About tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride

tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride (PubChem CID 159789040) has the molecular formula C136H187Cl3F4N8O14 and a molecular weight of 2340.38 g/mol. Its IUPAC name is tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride.

Molecular Properties

Compound Nametert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride
PubChem CID159789040
Molecular FormulaC136H187Cl3F4N8O14
Molecular Weight2340.38 g/mol
Exact Mass2337.32
IUPAC Nametert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride
SMILESC.CC(=O)N[C@@H](Cc1ccc(O)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H]1CO1.CC(C)c1cccc(C2(N)CCCCC2)c1.CC(C)c1cccc(C2(NC[C@@H](O)[C@H](Cc3ccc(OCc4ccccc4)c(F)c3)NC(=O)OC(C)(C)C)CCCCC2)c1.Cl.Cl.Cl.[H][H]
InChIInChI=1S/C37H49FN2O4.C34H43FN2O3.C27H37FN2O3.C22H26FNO4.C15H23N.CH4.3ClH.H2/c1-26(2)29-15-12-16-30(23-29)37(19-10-7-11-20-37)39-24-33(41)32(40-35(42)44-36(3,4)5)22-28-17-18-34(31(38)21-28)43-25-27-13-8-6-9-14-27;1-24(2)28-13-10-14-29(21-28)34(17-8-5-9-18-34)36-22-32(39)31(37-25(3)38)20-27-15-16-33(30(35)19-27)40-23-26-11-6-4-7-12-26;1-18(2)21-8-7-9-22(16-21)27(12-5-4-6-13-27)29-17-26(33)24(30-19(3)31)15-20-10-11-25(32)23(28)14-20;1-22(2,3)28-21(25)24-18(20-14-27-20)12-16-9-10-19(17(23)11-16)26-13-15-7-5-4-6-8-15;1-12(2)13-7-6-8-14(11-13)15(16)9-4-3-5-10-15;;;;;/h6,8-9,12-18,21,23,26,32-33,39,41H,7,10-11,19-20,22,24-25H2,1-5H3,(H,40,42);4,6-7,10-16,19,21,24,31-32,36,39H,5,8-9,17-18,20,22-23H2,1-3H3,(H,37,38);7-11,14,16,18,24,26,29,32-33H,4-6,12-13,15,17H2,1-3H3,(H,30,31);4-11,18,20H,12-14H2,1-3H3,(H,24,25);6-8,11-12H,3-5,9-10,16H2,1-2H3;1H4;4*1H/t32-,33+;31-,32+;24-,26+;18-,20+;;;;;;/m0000....../s1
InChIKeyDXXHODSVNLGJKC-RWXZVTFFSA-N
XLogP28.99
TPSA318.11 Ų
H-Bond Donors12
H-Bond Acceptors18
Rotatable Bonds42
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002340.38
LogP ≤ 528.99
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride?
The IUPAC name of tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride (CID 159789040) is tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride.
What is the SMILES notation for tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride?
The canonical SMILES for tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride is C.CC(=O)N[C@@H](Cc1ccc(O)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H](O)CNC1(c2cccc(C(C)C)c2)CCCCC1.CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(F)c1)[C@H]1CO1.CC(C)c1cccc(C2(N)CCCCC2)c1.CC(C)c1cccc(C2(NC[C@@H](O)[C@H](Cc3ccc(OCc4ccccc4)c(F)c3)NC(=O)OC(C)(C)C)CCCCC2)c1.Cl.Cl.Cl.[H][H].
What is the InChIKey of tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride?
The InChIKey is DXXHODSVNLGJKC-RWXZVTFFSA-N. The full InChI is InChI=1S/C37H49FN2O4.C34H43FN2O3.C27H37FN2O3.C22H26FNO4.C15H23N.CH4.3ClH.H2/c1-26(2)29-15-12-16-30(23-29)37(19-10-7-11-20-37)39-24-33(41)32(40-35(42)44-36(3,4)5)22-28-17-18-34(31(38)21-28)43-25-27-13-8-6-9-14-27;1-24(2)28-13-10-14-29(21-28)34(17-8-5-9-18-34)36-22-32(39)31(37-25(3)38)20-27-15-16-33(30(35)19-27)40-23-26-11-6-4-7-12-26;1-18(2)21-8-7-9-22(16-21)27(12-5-4-6-13-27)29-17-26(33)24(30-19(3)31)15-20-10-11-25(32)23(28)14-20;1-22(2,3)28-21(25)24-18(20-14-27-20)12-16-9-10-19(17(23)11-16)26-13-15-7-5-4-6-8-15;1-12(2)13-7-6-8-14(11-13)15(16)9-4-3-5-10-15;;;;;/h6,8-9,12-18,21,23,26,32-33,39,41H,7,10-11,19-20,22,24-25H2,1-5H3,(H,40,42);4,6-7,10-16,19,21,24,31-32,36,39H,5,8-9,17-18,20,22-23H2,1-3H3,(H,37,38);7-11,14,16,18,24,26,29,32-33H,4-6,12-13,15,17H2,1-3H3,(H,30,31);4-11,18,20H,12-14H2,1-3H3,(H,24,25);6-8,11-12H,3-5,9-10,16H2,1-2H3;1H4;4*1H/t32-,33+;31-,32+;24-,26+;18-,20+;;;;;;/m0000....../s1.
What are the key properties of tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride?
tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride has a molecular weight of 2340.38 g/mol, XLogP of 28.99, 42 rotatable bonds, 12 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]carbamate;tert-butyl N-[(1S)-2-(3-fluoro-4-phenylmethoxyphenyl)-1-[(2S)-oxiran-2-yl]ethyl]carbamate;N-[(2S,3R)-1-(3-fluoro-4-hydroxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;N-[(2S,3R)-1-(3-fluoro-4-phenylmethoxyphenyl)-3-hydroxy-4-[[1-(3-propan-2-ylphenyl)cyclohexyl]amino]butan-2-yl]acetamide;methane;molecular hydrogen;1-(3-propan-2-ylphenyl)cyclohexan-1-amine;trihydrochloride is sourced from PubChem (CID 159789040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).