(2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride

C98H148Cl2N12O7 — CID 159654938

About (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride

(2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride (PubChem CID 159654938) has the molecular formula C98H148Cl2N12O7 and a molecular weight of 1677.24 g/mol. Its IUPAC name is (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride.

Molecular Properties

• Compound Name: (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride
• PubChem CID: 159654938
• Molecular Formula: C98H148Cl2N12O7
• Molecular Weight: 1677.24 g/mol
• Exact Mass: 1675.10
• IUPAC Name: (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride
• SMILES: C=C[C@H]1COC(C)(C)N1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N1[C@@H](CNC2CCN(c3cccc(-c4ccc5c(c4)C(C)(C)CCC5(C)C)n3)CC2)COC1(C)C.CC1(C)CCC(C)(C)c2cc(-c3cccc(N4CCC(N)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3cccc(N4CCC(NC[C@@H](N)CO)CC4)n3)ccc21.Cl.Cl
• InChI: InChI=1S/C35H52N4O3.C27H40N4O.C24H33N3.C12H21NO3.2ClH/c1-32(2,3)42-31(40)39-26(23-41-35(39,8)9)22-36-25-15-19-38(20-16-25)30-12-10-11-29(37-30)24-13-14-27-28(21-24)34(6,7)18-17-33(27,4)5;1-26(2)12-13-27(3,4)23-16-19(8-9-22(23)26)24-6-5-7-25(30-24)31-14-10-21(11-15-31)29-17-20(28)18-32;1-23(2)12-13-24(3,4)20-16-17(8-9-19(20)23)21-6-5-7-22(26-21)27-14-10-18(25)11-15-27;1-7-9-8-15-12(5,6)13(9)10(14)16-11(2,3)4;;/h10-14,21,25-26,36H,15-20,22-23H2,1-9H3;5-9,16,20-21,29,32H,10-15,17-18,28H2,1-4H3;5-9,16,18H,10-15,25H2,1-4H3;7,9H,1,8H2,2-6H3;2*1H/t26-;20-;;9-;;/m01.0../s1
• InChIKey: AXSHUJFMFNFCMT-PMEKIEEDSA-N
• XLogP: 19.42
• TPSA: 222.26 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 17
• Rotatable Bonds: 14
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1677.24
LogP ≤ 5	19.42
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride?

The IUPAC name of (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride (CID 159654938) is (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride.

What is the SMILES notation for (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride?

The canonical SMILES for (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride is C=C[C@H]1COC(C)(C)N1C(=O)OC(C)(C)C.CC(C)(C)OC(=O)N1[C@@H](CNC2CCN(c3cccc(-c4ccc5c(c4)C(C)(C)CCC5(C)C)n3)CC2)COC1(C)C.CC1(C)CCC(C)(C)c2cc(-c3cccc(N4CCC(N)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3cccc(N4CCC(NC[C@@H](N)CO)CC4)n3)ccc21.Cl.Cl.

What is the InChIKey of (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride?

The InChIKey is AXSHUJFMFNFCMT-PMEKIEEDSA-N. The full InChI is InChI=1S/C35H52N4O3.C27H40N4O.C24H33N3.C12H21NO3.2ClH/c1-32(2,3)42-31(40)39-26(23-41-35(39,8)9)22-36-25-15-19-38(20-16-25)30-12-10-11-29(37-30)24-13-14-27-28(21-24)34(6,7)18-17-33(27,4)5;1-26(2)12-13-27(3,4)23-16-19(8-9-22(23)26)24-6-5-7-25(30-24)31-14-10-21(11-15-31)29-17-20(28)18-32;1-23(2)12-13-24(3,4)20-16-17(8-9-19(20)23)21-6-5-7-22(26-21)27-14-10-18(25)11-15-27;1-7-9-8-15-12(5,6)13(9)10(14)16-11(2,3)4;;/h10-14,21,25-26,36H,15-20,22-23H2,1-9H3;5-9,16,20-21,29,32H,10-15,17-18,28H2,1-4H3;5-9,16,18H,10-15,25H2,1-4H3;7,9H,1,8H2,2-6H3;2*1H/t26-;20-;;9-;;/m01.0../s1.

What are the key properties of (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride?

(2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride has a molecular weight of 1677.24 g/mol, XLogP of 19.42, 14 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-amino-3-[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]propan-1-ol;tert-butyl (4S)-2,2-dimethyl-4-[[[1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-yl]amino]methyl]-1,3-oxazolidine-3-carboxylate;tert-butyl (4S)-4-ethenyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate;1-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-2-pyridinyl]piperidin-4-amine;dihydrochloride is sourced from PubChem (CID 159654938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).