bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc

C14H32N4Zn-4 — CID 166057289

IUPACbis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc
SMILESC[N-]C(C)CC(C)[N-]C.C[N-]C(C)CC(C)[N-]C.[Zn]
InChIInChI=1S/2C7H16N2.Zn/c2*1-6(8-3)5-7(2)9-4;/h2*6-7H,5H2,1-4H3;/q2*-2;
InChIKeyHBOQSHZETBVVOH-UHFFFAOYSA-N
MW321.83 g/mol
LogP4.32
Rot. Bonds8

About bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc

bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc (PubChem CID 166057289) has the molecular formula C14H32N4Zn-4 and a molecular weight of 321.83 g/mol. Its IUPAC name is bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc.

Molecular Properties

Compound Namebis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc
PubChem CID166057289
Molecular FormulaC14H32N4Zn-4
Molecular Weight321.83 g/mol
Exact Mass320.19
IUPAC Namebis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc
SMILESC[N-]C(C)CC(C)[N-]C.C[N-]C(C)CC(C)[N-]C.[Zn]
InChIInChI=1S/2C7H16N2.Zn/c2*1-6(8-3)5-7(2)9-4;/h2*6-7H,5H2,1-4H3;/q2*-2;
InChIKeyHBOQSHZETBVVOH-UHFFFAOYSA-N
XLogP4.32
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.83
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;methyl(4-methylazanidylpentan-2-yl)azanide;zinc
CID 168728778
bis(diethylazanide);bis(methyl(4-methylazanidylpentan-2-yl)azanide);zirconium
CID 5252145
bis(methyl-(1,1,1-trifluoro-4-methylazanidylpentan-2-yl)azanide);nickel
CID 166057276
butan-2-yl(4-butan-2-ylazanidylpentan-2-yl)azanide;carbanide;zinc
CID 168728760
lithium ethyl(4-ethylazanidylpentan-2-yl)azanide
CID 59319218
bis(methyl(propan-2-yl)azanide);tungsten(2+)
CID 175494031
lanthanum(3+);methyl-[1-[methyl(2-methylazanidylpropyl)amino]propan-2-yl]azanide;methyl(trimethylsilyl)azanide
CID 161324446
2,4-dimethylpentane
CID 157050020
methyl-[(2S,4E,6E,8S,10S,12S,14S)-8,10,12,14-tetramethoxy-5,7-dimethylheptadeca-4,6,16-trien-2-yl]azanide
CID 163116873
2,4-dimethylpentane;methane
CID 159476318
nonane-2,4,6,8-tetramine
CID 142330039
methyl(2-methylpropyl)azanide;tungsten
CID 59806957

Frequently Asked Questions

What is the IUPAC name of bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc?
The IUPAC name of bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc (CID 166057289) is bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc.
What is the SMILES notation for bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc?
The canonical SMILES for bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc is C[N-]C(C)CC(C)[N-]C.C[N-]C(C)CC(C)[N-]C.[Zn].
What is the InChIKey of bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc?
The InChIKey is HBOQSHZETBVVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H16N2.Zn/c2*1-6(8-3)5-7(2)9-4;/h2*6-7H,5H2,1-4H3;/q2*-2;.
What are the key properties of bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc?
bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc has a molecular weight of 321.83 g/mol, XLogP of 4.32, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(methyl(4-methylazanidylpentan-2-yl)azanide);zinc is sourced from PubChem (CID 166057289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).