carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)

C26H50N4Ru — CID 59582768

IUPACcarbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)
SMILESCC1CC[N-]C(C2CC(C)CC[N-]2)C1.CC1CC[N-]C(C2CC(C)CC[N-]2)C1.[CH3-].[CH3-].[Ru+6]
InChIInChI=1S/2C12H22N2.2CH3.Ru/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;;;/h2*9-12H,3-8H2,1-2H3;2*1H3;/q2*-2;2*-1;+6
InChIKeyARUQWWGYNFSYEN-UHFFFAOYSA-N
MW519.78 g/mol
LogP7.56
Rot. Bonds2

About carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)

carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+) (PubChem CID 59582768) has the molecular formula C26H50N4Ru and a molecular weight of 519.78 g/mol. Its IUPAC name is carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+).

Molecular Properties

Compound Namecarbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)
PubChem CID59582768
Molecular FormulaC26H50N4Ru
Molecular Weight519.78 g/mol
Exact Mass520.31
IUPAC Namecarbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)
SMILESCC1CC[N-]C(C2CC(C)CC[N-]2)C1.CC1CC[N-]C(C2CC(C)CC[N-]2)C1.[CH3-].[CH3-].[Ru+6]
InChIInChI=1S/2C12H22N2.2CH3.Ru/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;;;/h2*9-12H,3-8H2,1-2H3;2*1H3;/q2*-2;2*-1;+6
InChIKeyARUQWWGYNFSYEN-UHFFFAOYSA-N
XLogP7.56
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms31
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500519.78
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)?
The IUPAC name of carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+) (CID 59582768) is carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+).
What is the SMILES notation for carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)?
The canonical SMILES for carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+) is CC1CC[N-]C(C2CC(C)CC[N-]2)C1.CC1CC[N-]C(C2CC(C)CC[N-]2)C1.[CH3-].[CH3-].[Ru+6].
What is the InChIKey of carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)?
The InChIKey is ARUQWWGYNFSYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H22N2.2CH3.Ru/c2*1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;;;/h2*9-12H,3-8H2,1-2H3;2*1H3;/q2*-2;2*-1;+6.
What are the key properties of carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)?
carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+) has a molecular weight of 519.78 g/mol, XLogP of 7.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+) is sourced from PubChem (CID 59582768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).