bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel

C22H52N4Ni-4 — CID 162282784

IUPACbis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel
SMILESCC.CC.CC(C)(C)[N-]C[N-]C(C)(C)C.CC(C)(C)[N-]C[N-]C(C)(C)C.[Ni]
InChIInChI=1S/2C9H20N2.2C2H6.Ni/c2*1-8(2,3)10-7-11-9(4,5)6;2*1-2;/h2*7H2,1-6H3;2*1-2H3;/q2*-2;;;
InChIKeyVHLDYBDPYRYRIQ-UHFFFAOYSA-N
MW431.38 g/mol
LogP8.63
Rot. Bonds4

About bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel

bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel (PubChem CID 162282784) has the molecular formula C22H52N4Ni-4 and a molecular weight of 431.38 g/mol. Its IUPAC name is bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel.

Molecular Properties

Compound Namebis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel
PubChem CID162282784
Molecular FormulaC22H52N4Ni-4
Molecular Weight431.38 g/mol
Exact Mass430.36
IUPAC Namebis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel
SMILESCC.CC.CC(C)(C)[N-]C[N-]C(C)(C)C.CC(C)(C)[N-]C[N-]C(C)(C)C.[Ni]
InChIInChI=1S/2C9H20N2.2C2H6.Ni/c2*1-8(2,3)10-7-11-9(4,5)6;2*1-2;/h2*7H2,1-6H3;2*1-2H3;/q2*-2;;;
InChIKeyVHLDYBDPYRYRIQ-UHFFFAOYSA-N
XLogP8.63
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.38
LogP ≤ 58.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tert-butyl(ethyl)azanide;ethane;yttrium
CID 158619467
dilithium;tert-butyl(2-tert-butylazanidylethyl)azanide
CID 59557620
bis(tert-butyl(2-tert-butylazanidylethyl)azanide);titanium(4+)
CID 87935492
tert-butyl(2-tert-butylazanidylethyl)azanide;manganese(2+)
CID 140844875
bis(tert-butyl(1-tert-butylazanidylethyl)azanide);nickel
CID 140639500
2,2-dimethylpropane;ethane;ethene
CID 143720811
tert-butyl(1-tert-butylazanidylpropan-2-yl)azanide;carbanide;hafnium(4+)
CID 169281312
potassium tert-butyl(2,3-dimethoxypropyl)azanide
CID 145053794
tert-butyl(methyl)azanide;rubidium(1+)
CID 165029324
tris(ditert-butylazanide);lanthanum(3+)
CID 58403090
1,2-dibromo-2-methylpropane;1,1,1-tribromo-2,2-dimethylpropane
CID 158802625
2,2-dimethylpropane;ethane;methane
CID 157153388

Frequently Asked Questions

What is the IUPAC name of bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel?
The IUPAC name of bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel (CID 162282784) is bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel.
What is the SMILES notation for bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel?
The canonical SMILES for bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel is CC.CC.CC(C)(C)[N-]C[N-]C(C)(C)C.CC(C)(C)[N-]C[N-]C(C)(C)C.[Ni].
What is the InChIKey of bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel?
The InChIKey is VHLDYBDPYRYRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H20N2.2C2H6.Ni/c2*1-8(2,3)10-7-11-9(4,5)6;2*1-2;/h2*7H2,1-6H3;2*1-2H3;/q2*-2;;;.
What are the key properties of bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel?
bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel has a molecular weight of 431.38 g/mol, XLogP of 8.63, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(tert-butyl(tert-butylazanidylmethyl)azanide);ethane;nickel is sourced from PubChem (CID 162282784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).