6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium

C62H170N11O+7 — CID 158149119

About 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium

6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium (PubChem CID 158149119) has the molecular formula C62H170N11O+7 and a molecular weight of 1086.12 g/mol. Its IUPAC name is 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium.

Molecular Properties

• Compound Name: 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium
• PubChem CID: 158149119
• Molecular Formula: C62H170N11O+7
• Molecular Weight: 1086.12 g/mol
• Exact Mass: 1085.36
• IUPAC Name: 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.CN(C)CCCCCC[N+](C)(C)C.CN1CCN(C)CC1.CN1CC[N+](C)(C)CC1.C[N+](C)(C)CCCCCC[N+](C)(C)C.C[N+]1(C)CCOCC1.C[N+]1(C)CC[N+](C)(C)CC1
• InChI: InChI=1S/C12H30N2.C11H27N2.C8H20N2.C7H17N2.C6H14N2.C6H14NO.12CH4/c1-13(2,3)11-9-7-8-10-12-14(4,5)6;1-12(2)10-8-6-7-9-11-13(3,4)5;1-9(2)5-7-10(3,4)8-6-9;1-8-4-6-9(2,3)7-5-8;1-7-3-5-8(2)6-4-7;1-7(2)3-5-8-6-4-7;;;;;;;;;;;;/h7-12H2,1-6H3;6-11H2,1-5H3;5-8H2,1-4H3;4-7H2,1-3H3;2*3-6H2,1-2H3;12*1H4/q+2;+1;+2;+1;;+1
• InChIKey: ATHTUQWXCKKIPA-UHFFFAOYSA-N
• XLogP: 11.52
• TPSA: 22.19 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 14
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1086.12
LogP ≤ 5	11.52
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium?

The IUPAC name of 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium (CID 158149119) is 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium.

What is the SMILES notation for 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium?

The canonical SMILES for 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium is C.C.C.C.C.C.C.C.C.C.C.C.CN(C)CCCCCC[N+](C)(C)C.CN1CCN(C)CC1.CN1CC[N+](C)(C)CC1.C[N+](C)(C)CCCCCC[N+](C)(C)C.C[N+]1(C)CCOCC1.C[N+]1(C)CC[N+](C)(C)CC1.

What is the InChIKey of 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium?

The InChIKey is ATHTUQWXCKKIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30N2.C11H27N2.C8H20N2.C7H17N2.C6H14N2.C6H14NO.12CH4/c1-13(2,3)11-9-7-8-10-12-14(4,5)6;1-12(2)10-8-6-7-9-11-13(3,4)5;1-9(2)5-7-10(3,4)8-6-9;1-8-4-6-9(2,3)7-5-8;1-7-3-5-8(2)6-4-7;1-7(2)3-5-8-6-4-7;;;;;;;;;;;;/h7-12H2,1-6H3;6-11H2,1-5H3;5-8H2,1-4H3;4-7H2,1-3H3;2*3-6H2,1-2H3;12*1H4/q+2;+1;+2;+1;;+1;;;;;;;;;;;;.

What are the key properties of 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium?

6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium has a molecular weight of 1086.12 g/mol, XLogP of 11.52, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(dimethylamino)hexyl-trimethylazanium;4,4-dimethylmorpholin-4-ium;1,4-dimethylpiperazine;methane;1,1,4,4-tetramethylpiperazine-1,4-diium;1,1,4-trimethylpiperazin-1-ium;trimethyl-[6-(trimethylazaniumyl)hexyl]azanium is sourced from PubChem (CID 158149119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).