methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)

C20H42N4O2Ru — CID 154626137

IUPACmethanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
SMILESCCC([N-]C(C)C)[N-]C(C)C.CCC([N-]C(C)C)[N-]C(C)C.[CH-]=O.[CH-]=O.[Ru+6]
InChIInChI=1S/2C9H20N2.2CHO.Ru/c2*1-6-9(10-7(2)3)11-8(4)5;2*1-2;/h2*7-9H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6
InChIKeyYIKXVZNPHPFHBC-UHFFFAOYSA-N
MW471.65 g/mol
LogP6.02
Rot. Bonds10

About methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)

methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+) (PubChem CID 154626137) has the molecular formula C20H42N4O2Ru and a molecular weight of 471.65 g/mol. Its IUPAC name is methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+).

Molecular Properties

Compound Namemethanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
PubChem CID154626137
Molecular FormulaC20H42N4O2Ru
Molecular Weight471.65 g/mol
Exact Mass472.24
IUPAC Namemethanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
SMILESCCC([N-]C(C)C)[N-]C(C)C.CCC([N-]C(C)C)[N-]C(C)C.[CH-]=O.[CH-]=O.[Ru+6]
InChIInChI=1S/2C9H20N2.2CHO.Ru/c2*1-6-9(10-7(2)3)11-8(4)5;2*1-2;/h2*7-9H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6
InChIKeyYIKXVZNPHPFHBC-UHFFFAOYSA-N
XLogP6.02
TPSA90.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.65
LogP ≤ 56.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methanone;bis(methyl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
CID 154626285
bis(2-methylbutan-2-ylimino)molybdenum;2-methylpropane;propan-2-yl(1-propan-2-ylazanidylpropyl)azanide
CID 162467898
bis(tert-butyl(1-propan-2-ylazanidylethyl)azanide);methanone;ruthenium(6+)
CID 154626159
bis(diethylazanide);bis(di(propan-2-yl)azanide);molybdenum(4+)
CID 87312374
tris(diethylazanide);di(propan-2-yl)azanide;tungsten
CID 87312600
tris(diethylazanide);di(propan-2-yl)azanide;titanium(4+)
CID 87312949
methanone;bis(2-methylbutan-2-yl-(2-methyl-1-propan-2-ylazanidylbutyl)azanide);ruthenium(6+)
CID 154626258
methanone;bis(methyl(1-propylazanidylpropyl)azanide);ruthenium(6+)
CID 154626406
bis(tert-butyl-(2,2-dimethyl-1-propan-2-ylazanidylbutyl)azanide);methanone;ruthenium(6+)
CID 154626385
bis(di(propan-2-yl)azanide);molybdenum(2+)
CID 141200548
bis(tert-butyl-[1-(2-methylbutan-2-ylazanidyl)propyl]azanide);methanone;ruthenium(6+)
CID 154626208
butan-2-yl(1-propan-2-ylazanidylethyl)azanide;carbanide;yttrium
CID 167346325

Frequently Asked Questions

What is the IUPAC name of methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)?
The IUPAC name of methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+) (CID 154626137) is methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+).
What is the SMILES notation for methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)?
The canonical SMILES for methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+) is CCC([N-]C(C)C)[N-]C(C)C.CCC([N-]C(C)C)[N-]C(C)C.[CH-]=O.[CH-]=O.[Ru+6].
What is the InChIKey of methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)?
The InChIKey is YIKXVZNPHPFHBC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H20N2.2CHO.Ru/c2*1-6-9(10-7(2)3)11-8(4)5;2*1-2;/h2*7-9H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6.
What are the key properties of methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)?
methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+) has a molecular weight of 471.65 g/mol, XLogP of 6.02, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+) is sourced from PubChem (CID 154626137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).