2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)

C152H286N12O10 — CID 158046977

About 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)

2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane) (PubChem CID 158046977) has the molecular formula C152H286N12O10 and a molecular weight of 2442.03 g/mol. Its IUPAC name is 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane).

Molecular Properties

• Compound Name: 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)
• PubChem CID: 158046977
• Molecular Formula: C152H286N12O10
• Molecular Weight: 2442.03 g/mol
• Exact Mass: 2440.22
• IUPAC Name: 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)
• SMILES: CC(C)(C)CCCCCC(C)(C)C.CC(C)(C)CCCCCC(C)(C)C.CC(C)(C)CCCCOC(C)(C)C.CC(C)(C)Cc1cc(CC(C)(C)C)on1.CC(C)(C)Cc1cc(CC(C)(C)C)on1.CC(C)(C)Cc1cnc(CC(C)(C)C)o1.CC(C)(C)Cc1cnc(CC(C)(C)C)o1.CC(C)(C)Cc1coc(CC(C)(C)C)n1.CC(C)(C)Cc1coc(CC(C)(C)C)n1.CC(C)(C)Cc1nnc(CC(C)(C)C)o1.CC(C)(C)Cc1noc(CC(C)(C)C)n1.CC(C)(C)Cc1noc(CC(C)(C)C)n1
• InChI: InChI=1S/6C13H23NO.2C13H28.3C12H22N2O.C12H26O/c2*1-12(2,3)7-10-9-15-11(14-10)8-13(4,5)6;2*1-12(2,3)7-10-9-14-11(15-10)8-13(4,5)6;2*1-12(2,3)8-10-7-11(15-14-10)9-13(4,5)6;2*1-12(2,3)10-8-7-9-11-13(4,5)6;1-11(2,3)7-9-13-14-10(15-9)8-12(4,5)6;2*1-11(2,3)7-9-13-10(15-14-9)8-12(4,5)6;1-11(2,3)9-7-8-10-13-12(4,5)6/h4*9H,7-8H2,1-6H3;2*7H,8-9H2,1-6H3;2*7-11H2,1-6H3;3*7-8H2,1-6H3;7-10H2,1-6H3
• InChIKey: FJANMXRJKYBCSR-UHFFFAOYSA-N
• XLogP: 46.93
• TPSA: 282.17 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 30
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2442.03
LogP ≤ 5	46.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)?

The IUPAC name of 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane) (CID 158046977) is 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane).

What is the SMILES notation for 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)?

The canonical SMILES for 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane) is CC(C)(C)CCCCCC(C)(C)C.CC(C)(C)CCCCCC(C)(C)C.CC(C)(C)CCCCOC(C)(C)C.CC(C)(C)Cc1cc(CC(C)(C)C)on1.CC(C)(C)Cc1cc(CC(C)(C)C)on1.CC(C)(C)Cc1cnc(CC(C)(C)C)o1.CC(C)(C)Cc1cnc(CC(C)(C)C)o1.CC(C)(C)Cc1coc(CC(C)(C)C)n1.CC(C)(C)Cc1coc(CC(C)(C)C)n1.CC(C)(C)Cc1nnc(CC(C)(C)C)o1.CC(C)(C)Cc1noc(CC(C)(C)C)n1.CC(C)(C)Cc1noc(CC(C)(C)C)n1.

What is the InChIKey of 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)?

The InChIKey is FJANMXRJKYBCSR-UHFFFAOYSA-N. The full InChI is InChI=1S/6C13H23NO.2C13H28.3C12H22N2O.C12H26O/c2*1-12(2,3)7-10-9-15-11(14-10)8-13(4,5)6;2*1-12(2,3)7-10-9-14-11(15-10)8-13(4,5)6;2*1-12(2,3)8-10-7-11(15-14-10)9-13(4,5)6;2*1-12(2,3)10-8-7-9-11-13(4,5)6;1-11(2,3)7-9-13-14-10(15-9)8-12(4,5)6;2*1-11(2,3)7-9-13-10(15-14-9)8-12(4,5)6;1-11(2,3)9-7-8-10-13-12(4,5)6/h4*9H,7-8H2,1-6H3;2*7H,8-9H2,1-6H3;2*7-11H2,1-6H3;3*7-8H2,1-6H3;7-10H2,1-6H3.

What are the key properties of 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane)?

2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane) has a molecular weight of 2442.03 g/mol, XLogP of 46.93, 30 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-bis(2,2-dimethylpropyl)-1,3,4-oxadiazole;bis(3,5-bis(2,2-dimethylpropyl)-1,2,4-oxadiazole);bis(2,4-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(2,5-bis(2,2-dimethylpropyl)-1,3-oxazole);bis(3,5-bis(2,2-dimethylpropyl)-1,2-oxazole);5,5-dimethyl-1-[(2-methylpropan-2-yl)oxy]hexane;bis(2,2,8,8-tetramethylnonane) is sourced from PubChem (CID 158046977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).