methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)

C18H38N4O2Ru — CID 154626481

IUPACmethanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)
SMILESCCC(C)(C)[N-]C(C)[N-]C.CCC(C)(C)[N-]C(C)[N-]C.[CH-]=O.[CH-]=O.[Ru+6]
InChIInChI=1S/2C8H18N2.2CHO.Ru/c2*1-6-8(3,4)10-7(2)9-5;2*1-2;/h2*7H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6
InChIKeyPNOOCSZVYYVHBH-UHFFFAOYSA-N
MW443.60 g/mol
LogP5.25
Rot. Bonds8

About methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)

methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+) (PubChem CID 154626481) has the molecular formula C18H38N4O2Ru and a molecular weight of 443.60 g/mol. Its IUPAC name is methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+).

Molecular Properties

Compound Namemethanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)
PubChem CID154626481
Molecular FormulaC18H38N4O2Ru
Molecular Weight443.60 g/mol
Exact Mass444.20
IUPAC Namemethanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)
SMILESCCC(C)(C)[N-]C(C)[N-]C.CCC(C)(C)[N-]C(C)[N-]C.[CH-]=O.[CH-]=O.[Ru+6]
InChIInChI=1S/2C8H18N2.2CHO.Ru/c2*1-6-8(3,4)10-7(2)9-5;2*1-2;/h2*7H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6
InChIKeyPNOOCSZVYYVHBH-UHFFFAOYSA-N
XLogP5.25
TPSA90.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.60
LogP ≤ 55.25
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

bis([2,2-dimethyl-1-(2-methylbutan-2-ylazanidyl)propyl]-(2-methylbutan-2-yl)azanide);methanone;ruthenium(6+)
CID 154626212
bis(tert-butyl-[1-(2-methylbutan-2-ylazanidyl)propyl]azanide);methanone;ruthenium(6+)
CID 154626208
methanone;bis(2-methylbutan-2-yl-(2-methyl-1-propan-2-ylazanidylbutyl)azanide);ruthenium(6+)
CID 154626258
bis((2,2-dimethyl-1-methylazanidylbutyl)-methylazanide);methanone;ruthenium(6+)
CID 154626487
bis(ethyl-[1-(2-methylbutan-2-ylazanidyl)butyl]azanide);methanone;ruthenium(6+)
CID 154626467
bis(tert-butyl-(2,2-dimethyl-1-propan-2-ylazanidylbutyl)azanide);methanone;ruthenium(6+)
CID 154626385
bis(tert-butyl(1-propan-2-ylazanidylethyl)azanide);methanone;ruthenium(6+)
CID 154626159
methanone;bis(methyl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
CID 154626285
methanone;bis(methyl(1-methylazanidylbutyl)azanide);ruthenium(6+)
CID 154626171
methanone;bis(methyl-(2-methyl-1-methylazanidylpropyl)azanide);ruthenium(6+)
CID 154626413
tert-butyl(1-ethylazanidylethyl)azanide;tris(dimethylazanide);titanium
CID 153316686
methanone;bis(propan-2-yl(1-propan-2-ylazanidylpropyl)azanide);ruthenium(6+)
CID 154626137

Frequently Asked Questions

What is the IUPAC name of methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)?
The IUPAC name of methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+) (CID 154626481) is methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+).
What is the SMILES notation for methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)?
The canonical SMILES for methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+) is CCC(C)(C)[N-]C(C)[N-]C.CCC(C)(C)[N-]C(C)[N-]C.[CH-]=O.[CH-]=O.[Ru+6].
What is the InChIKey of methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)?
The InChIKey is PNOOCSZVYYVHBH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H18N2.2CHO.Ru/c2*1-6-8(3,4)10-7(2)9-5;2*1-2;/h2*7H,6H2,1-5H3;2*1H;/q2*-2;2*-1;+6.
What are the key properties of methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+)?
methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+) has a molecular weight of 443.60 g/mol, XLogP of 5.25, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanone;bis(methyl-[1-(2-methylbutan-2-ylazanidyl)ethyl]azanide);ruthenium(6+) is sourced from PubChem (CID 154626481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).