(2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol

C134H199BrN14O8S5 — CID 158525282

About (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol

(2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol (PubChem CID 158525282) has the molecular formula C134H199BrN14O8S5 and a molecular weight of 2374.39 g/mol. Its IUPAC name is (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol.

Molecular Properties

• Compound Name: (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol
• PubChem CID: 158525282
• Molecular Formula: C134H199BrN14O8S5
• Molecular Weight: 2374.39 g/mol
• Exact Mass: 2371.34
• IUPAC Name: (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol
• SMILES: CC1(C)CCC(C)(C)c2cc(-c3csc(C4CCN(CCCCCCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3csc(N4CCC(N(CCO)CCCCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3csc(N4CCC(NC(=O)[C@@H](N)CCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3nc(N4CCC(N(CCO)CCCCO)CC4)sc3Br)ccc21.CC1CCC(C)c2cc(-c3csc(C4CCN(CCCCO)CC4)n3)ccc21
• InChI: InChI=1S/C28H42BrN3O2S.C28H43N3O2S.C28H42N2OS.C26H38N4O2S.C24H34N2OS/c1-27(2)11-12-28(3,4)23-19-20(7-8-22(23)27)24-25(29)35-26(30-24)32-14-9-21(10-15-32)31(16-18-34)13-5-6-17-33;1-27(2)11-12-28(3,4)24-19-21(7-8-23(24)27)25-20-34-26(29-25)31-14-9-22(10-15-31)30(16-18-33)13-5-6-17-32;1-27(2)13-14-28(3,4)24-19-22(9-10-23(24)27)25-20-32-26(29-25)21-11-16-30(17-12-21)15-7-5-6-8-18-31;1-25(2)10-11-26(3,4)20-15-17(5-6-19(20)25)22-16-33-24(29-22)30-12-7-18(8-13-30)28-23(32)21(27)9-14-31;1-17-5-6-18(2)22-15-20(7-8-21(17)22)23-16-28-24(25-23)19-9-12-26(13-10-19)11-3-4-14-27/h7-8,19,21,33-34H,5-6,9-18H2,1-4H3;7-8,19-20,22,32-33H,5-6,9-18H2,1-4H3;9-10,19-21,31H,5-8,11-18H2,1-4H3;5-6,15-16,18,21,31H,7-14,27H2,1-4H3,(H,28,32);7-8,15-19,27H,3-6,9-14H2,1-2H3/t;;;21-;/m...0./s1
• InChIKey: HMSFBFYFURFSKT-LOCNPRDZSA-N
• XLogP: 27.76
• TPSA: 283.86 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 26
• Rotatable Bonds: 38
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2374.39
LogP ≤ 5	27.76
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol?

The IUPAC name of (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol (CID 158525282) is (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol.

What is the SMILES notation for (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol?

The canonical SMILES for (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol is CC1(C)CCC(C)(C)c2cc(-c3csc(C4CCN(CCCCCCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3csc(N4CCC(N(CCO)CCCCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3csc(N4CCC(NC(=O)[C@@H](N)CCO)CC4)n3)ccc21.CC1(C)CCC(C)(C)c2cc(-c3nc(N4CCC(N(CCO)CCCCO)CC4)sc3Br)ccc21.CC1CCC(C)c2cc(-c3csc(C4CCN(CCCCO)CC4)n3)ccc21.

What is the InChIKey of (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol?

The InChIKey is HMSFBFYFURFSKT-LOCNPRDZSA-N. The full InChI is InChI=1S/C28H42BrN3O2S.C28H43N3O2S.C28H42N2OS.C26H38N4O2S.C24H34N2OS/c1-27(2)11-12-28(3,4)23-19-20(7-8-22(23)27)24-25(29)35-26(30-24)32-14-9-21(10-15-32)31(16-18-34)13-5-6-17-33;1-27(2)11-12-28(3,4)24-19-21(7-8-23(24)27)25-20-34-26(29-25)31-14-9-22(10-15-31)30(16-18-33)13-5-6-17-32;1-27(2)13-14-28(3,4)24-19-22(9-10-23(24)27)25-20-32-26(29-25)21-11-16-30(17-12-21)15-7-5-6-8-18-31;1-25(2)10-11-26(3,4)20-15-17(5-6-19(20)25)22-16-33-24(29-22)30-12-7-18(8-13-30)28-23(32)21(27)9-14-31;1-17-5-6-18(2)22-15-20(7-8-21(17)22)23-16-28-24(25-23)19-9-12-26(13-10-19)11-3-4-14-27/h7-8,19,21,33-34H,5-6,9-18H2,1-4H3;7-8,19-20,22,32-33H,5-6,9-18H2,1-4H3;9-10,19-21,31H,5-8,11-18H2,1-4H3;5-6,15-16,18,21,31H,7-14,27H2,1-4H3,(H,28,32);7-8,15-19,27H,3-6,9-14H2,1-2H3/t;;;21-;/m...0./s1.

What are the key properties of (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol?

(2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol has a molecular weight of 2374.39 g/mol, XLogP of 27.76, 38 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-amino-4-hydroxy-N-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]butanamide;4-[[1-[5-bromo-4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]-(2-hydroxyethyl)amino]butan-1-ol;4-[4-[4-(5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]butan-1-ol;4-[2-hydroxyethyl-[1-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-4-yl]amino]butan-1-ol;6-[4-[4-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1,3-thiazol-2-yl]piperidin-1-yl]hexan-1-ol is sourced from PubChem (CID 158525282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).