tris(diethylazanide);di(propan-2-yl)azanide;tungsten

C18H44N4W-4 — CID 87312600

IUPACtris(diethylazanide);di(propan-2-yl)azanide;tungsten
SMILESCC(C)[N-]C(C)C.CC[N-]CC.CC[N-]CC.CC[N-]CC.[W]
InChIInChI=1S/C6H14N.3C4H10N.W/c1-5(2)7-6(3)4;3*1-3-5-4-2;/h5-6H,1-4H3;3*3-4H2,1-2H3;/q4*-1;
InChIKeyZZQQIRJYJPUOTB-UHFFFAOYSA-N
MW500.42 g/mol
LogP6.37
Rot. Bonds8

About tris(diethylazanide);di(propan-2-yl)azanide;tungsten

tris(diethylazanide);di(propan-2-yl)azanide;tungsten (PubChem CID 87312600) has the molecular formula C18H44N4W-4 and a molecular weight of 500.42 g/mol. Its IUPAC name is tris(diethylazanide);di(propan-2-yl)azanide;tungsten.

Molecular Properties

Compound Nametris(diethylazanide);di(propan-2-yl)azanide;tungsten
PubChem CID87312600
Molecular FormulaC18H44N4W-4
Molecular Weight500.42 g/mol
Exact Mass500.31
IUPAC Nametris(diethylazanide);di(propan-2-yl)azanide;tungsten
SMILESCC(C)[N-]C(C)C.CC[N-]CC.CC[N-]CC.CC[N-]CC.[W]
InChIInChI=1S/C6H14N.3C4H10N.W/c1-5(2)7-6(3)4;3*1-3-5-4-2;/h5-6H,1-4H3;3*3-4H2,1-2H3;/q4*-1;
InChIKeyZZQQIRJYJPUOTB-UHFFFAOYSA-N
XLogP6.37
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.42
LogP ≤ 56.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tris(diethylazanide);di(propan-2-yl)azanide;tungsten?
The IUPAC name of tris(diethylazanide);di(propan-2-yl)azanide;tungsten (CID 87312600) is tris(diethylazanide);di(propan-2-yl)azanide;tungsten.
What is the SMILES notation for tris(diethylazanide);di(propan-2-yl)azanide;tungsten?
The canonical SMILES for tris(diethylazanide);di(propan-2-yl)azanide;tungsten is CC(C)[N-]C(C)C.CC[N-]CC.CC[N-]CC.CC[N-]CC.[W].
What is the InChIKey of tris(diethylazanide);di(propan-2-yl)azanide;tungsten?
The InChIKey is ZZQQIRJYJPUOTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N.3C4H10N.W/c1-5(2)7-6(3)4;3*1-3-5-4-2;/h5-6H,1-4H3;3*3-4H2,1-2H3;/q4*-1;.
What are the key properties of tris(diethylazanide);di(propan-2-yl)azanide;tungsten?
tris(diethylazanide);di(propan-2-yl)azanide;tungsten has a molecular weight of 500.42 g/mol, XLogP of 6.37, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(diethylazanide);di(propan-2-yl)azanide;tungsten is sourced from PubChem (CID 87312600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).