copper;tris(N-ethyl-N-methanidylethanamine)

C15H36CuN3-3 — CID 163917323

IUPACcopper;tris(N-ethyl-N-methanidylethanamine)
SMILES[CH2-]N(CC)CC.[CH2-]N(CC)CC.[CH2-]N(CC)CC.[Cu]
InChIInChI=1S/3C5H12N.Cu/c3*1-4-6(3)5-2;/h3*3-5H2,1-2H3;/q3*-1;
InChIKeyVVZNAVGELKEWSC-UHFFFAOYSA-N
MW322.02 g/mol
LogP3.36
Rot. Bonds6

About copper;tris(N-ethyl-N-methanidylethanamine)

copper;tris(N-ethyl-N-methanidylethanamine) (PubChem CID 163917323) has the molecular formula C15H36CuN3-3 and a molecular weight of 322.02 g/mol. Its IUPAC name is copper;tris(N-ethyl-N-methanidylethanamine).

Molecular Properties

Compound Namecopper;tris(N-ethyl-N-methanidylethanamine)
PubChem CID163917323
Molecular FormulaC15H36CuN3-3
Molecular Weight322.02 g/mol
Exact Mass321.22
IUPAC Namecopper;tris(N-ethyl-N-methanidylethanamine)
SMILES[CH2-]N(CC)CC.[CH2-]N(CC)CC.[CH2-]N(CC)CC.[Cu]
InChIInChI=1S/3C5H12N.Cu/c3*1-4-6(3)5-2;/h3*3-5H2,1-2H3;/q3*-1;
InChIKeyVVZNAVGELKEWSC-UHFFFAOYSA-N
XLogP3.36
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.02
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-methanidylethanamine;rhenium
CID 59858121
N-ethyl-N-methanidylpropan-1-amine
CID 59691637
N-ethyl-N-methanidylpropan-1-amine;yttrium
CID 165098751
copper;propane
CID 159395647
N,N-diethylethanamine;ethane
CID 22114990
carbanide;N-methanidyl-N-methylmethanamine;tungsten(2+)
CID 21357336
N,3-diethyl-N-methanidylpentan-3-amine;ethane;yttrium(3+)
CID 58729424
azane;N,N-dimethylethanamine
CID 91593223
bis(N,N-dimethylethanamine);methane
CID 160872665
N,N-dimethylethanamine;hydroiodide
CID 173048873
N,N-diethylethanamine;palladium(2+)
CID 22219787
CID 175820473
CID 175820473

Frequently Asked Questions

What is the IUPAC name of copper;tris(N-ethyl-N-methanidylethanamine)?
The IUPAC name of copper;tris(N-ethyl-N-methanidylethanamine) (CID 163917323) is copper;tris(N-ethyl-N-methanidylethanamine).
What is the SMILES notation for copper;tris(N-ethyl-N-methanidylethanamine)?
The canonical SMILES for copper;tris(N-ethyl-N-methanidylethanamine) is [CH2-]N(CC)CC.[CH2-]N(CC)CC.[CH2-]N(CC)CC.[Cu].
What is the InChIKey of copper;tris(N-ethyl-N-methanidylethanamine)?
The InChIKey is VVZNAVGELKEWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H12N.Cu/c3*1-4-6(3)5-2;/h3*3-5H2,1-2H3;/q3*-1;.
What are the key properties of copper;tris(N-ethyl-N-methanidylethanamine)?
copper;tris(N-ethyl-N-methanidylethanamine) has a molecular weight of 322.02 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper;tris(N-ethyl-N-methanidylethanamine) is sourced from PubChem (CID 163917323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).