tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)

C18H46N5Nb — CID 87312528

IUPACtris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)
SMILESCC(C)[N-]C(C)C.CC(C)[N-]C(C)C.C[N-]C.C[N-]C.C[N-]C.[Nb+5]
InChIInChI=1S/2C6H14N.3C2H6N.Nb/c2*1-5(2)7-6(3)4;3*1-3-2;/h2*5-6H,1-4H3;3*1-2H3;/q5*-1;+5
InChIKeyNKCBLIGHSXZOBP-UHFFFAOYSA-N
MW425.51 g/mol
LogP6.21
Rot. Bonds4

About tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)

tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+) (PubChem CID 87312528) has the molecular formula C18H46N5Nb and a molecular weight of 425.51 g/mol. Its IUPAC name is tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+).

Molecular Properties

Compound Nametris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)
PubChem CID87312528
Molecular FormulaC18H46N5Nb
Molecular Weight425.51 g/mol
Exact Mass425.28
IUPAC Nametris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)
SMILESCC(C)[N-]C(C)C.CC(C)[N-]C(C)C.C[N-]C.C[N-]C.C[N-]C.[Nb+5]
InChIInChI=1S/2C6H14N.3C2H6N.Nb/c2*1-5(2)7-6(3)4;3*1-3-2;/h2*5-6H,1-4H3;3*1-2H3;/q5*-1;+5
InChIKeyNKCBLIGHSXZOBP-UHFFFAOYSA-N
XLogP6.21
TPSA70.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.51
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bis(di(propan-2-yl)azanide);molybdenum(2+)
CID 141200548
bis(di(propan-2-yl)azanide);neodymium;hydrochloride
CID 87163735
di(propan-2-yl)azanide;titanium(3+);dichloride
CID 160772025
carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium
CID 58635676
bis(methyl(propan-2-yl)azanide);tungsten(2+)
CID 175494031
aluminum;dimethylazanide;bis(2-methanidylpropane)
CID 15977879
butan-2-yl(1-propan-2-ylazanidylethyl)azanide;carbanide;yttrium
CID 167346325
tris(diethylazanide);di(propan-2-yl)azanide;tungsten
CID 87312600
bis(diethylazanide);bis(di(propan-2-yl)azanide);molybdenum(4+)
CID 87312374
trilithium;bis(trimethylsilyl)azanide;di(propan-2-yl)azanide;hydride
CID 173345693
tris(diethylazanide);di(propan-2-yl)azanide;titanium(4+)
CID 87312949
lithium;di(propan-2-yl)azanide;bis(trimethyl borate)
CID 23709742

Frequently Asked Questions

What is the IUPAC name of tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)?
The IUPAC name of tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+) (CID 87312528) is tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+).
What is the SMILES notation for tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)?
The canonical SMILES for tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+) is CC(C)[N-]C(C)C.CC(C)[N-]C(C)C.C[N-]C.C[N-]C.C[N-]C.[Nb+5].
What is the InChIKey of tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)?
The InChIKey is NKCBLIGHSXZOBP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H14N.3C2H6N.Nb/c2*1-5(2)7-6(3)4;3*1-3-2;/h2*5-6H,1-4H3;3*1-2H3;/q5*-1;+5.
What are the key properties of tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)?
tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+) has a molecular weight of 425.51 g/mol, XLogP of 6.21, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+) is sourced from PubChem (CID 87312528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).