boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)

C15H37BNO6Rb — CID 139243294

About boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)

boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+) (PubChem CID 139243294) has the molecular formula C15H37BNO6Rb and a molecular weight of 423.74 g/mol. Its IUPAC name is boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+).

Molecular Properties

• Compound Name: boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)
• PubChem CID: 139243294
• Molecular Formula: C15H37BNO6Rb
• Molecular Weight: 423.74 g/mol
• Exact Mass: 423.18
• IUPAC Name: boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)
• SMILES: COCCOCCN(CCOCCOC)CCOCCOC.[BH4-].[Rb+]
• InChI: InChI=1S/C15H33NO6.BH4.Rb/c1-17-10-13-20-7-4-16(5-8-21-14-11-18-2)6-9-22-15-12-19-3;;/h4-15H2,1-3H3;1H4;/q;-1;+1
• InChIKey: XDVPXKLWAHAUEM-UHFFFAOYSA-N
• XLogP: -4.17
• TPSA: 58.62 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 18
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	423.74
LogP ≤ 5	-4.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)?

The IUPAC name of boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+) (CID 139243294) is boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+).

What is the SMILES notation for boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)?

The canonical SMILES for boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+) is COCCOCCN(CCOCCOC)CCOCCOC.[BH4-].[Rb+].

What is the InChIKey of boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)?

The InChIKey is XDVPXKLWAHAUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO6.BH4.Rb/c1-17-10-13-20-7-4-16(5-8-21-14-11-18-2)6-9-22-15-12-19-3;;/h4-15H2,1-3H3;1H4;/q;-1;+1.

What are the key properties of boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+)?

boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+) has a molecular weight of 423.74 g/mol, XLogP of -4.17, 18 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for boranuide;2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]ethanamine;rubidium(1+) is sourced from PubChem (CID 139243294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).