carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium

C11H27N2Zr-5 — CID 58635676

IUPACcarbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium
SMILESCC(C)[N-]C(C)[N-]C(C)C.[CH3-].[CH3-].[CH3-].[Zr]
InChIInChI=1S/C8H18N2.3CH3.Zr/c1-6(2)9-8(5)10-7(3)4;;;;/h6-8H,1-5H3;3*1H3;/q-2;3*-1;
InChIKeyYDOPCAAFLPHHTQ-UHFFFAOYSA-N
MW278.58 g/mol
LogP4.24
Rot. Bonds4

About carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium

carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium (PubChem CID 58635676) has the molecular formula C11H27N2Zr-5 and a molecular weight of 278.58 g/mol. Its IUPAC name is carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium.

Molecular Properties

Compound Namecarbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium
PubChem CID58635676
Molecular FormulaC11H27N2Zr-5
Molecular Weight278.58 g/mol
Exact Mass277.12
IUPAC Namecarbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium
SMILESCC(C)[N-]C(C)[N-]C(C)C.[CH3-].[CH3-].[CH3-].[Zr]
InChIInChI=1S/C8H18N2.3CH3.Zr/c1-6(2)9-8(5)10-7(3)4;;;;/h6-8H,1-5H3;3*1H3;/q-2;3*-1;
InChIKeyYDOPCAAFLPHHTQ-UHFFFAOYSA-N
XLogP4.24
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.58
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butan-2-yl(1-propan-2-ylazanidylethyl)azanide;carbanide;yttrium
CID 167346325
tris(dimethylazanide);bis(di(propan-2-yl)azanide);niobium(5+)
CID 87312528
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
trilithium;bis(trimethylsilyl)azanide;di(propan-2-yl)azanide;hydride
CID 173345693
bis(tert-butyl(1-propan-2-ylazanidylethyl)azanide);methanone;ruthenium(6+)
CID 154626159
bis(methyl(propan-2-yl)azanide);tungsten(2+)
CID 175494031
carbanide;3-cyclopentyl-N,N-dimethylpropan-1-amine;lanthanum;propan-2-yl(1-propan-2-ylazanidylethyl)azanide
CID 172526261
carbanide;[[di(propan-2-yl)amino]-propan-2-ylazanidylmethyl]-propan-2-ylazanide;iridium
CID 135011154
tris(diethylazanide);di(propan-2-yl)azanide;tungsten
CID 87312600
tris(diethylazanide);di(propan-2-yl)azanide;titanium(4+)
CID 87312949

Frequently Asked Questions

What is the IUPAC name of carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium?
The IUPAC name of carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium (CID 58635676) is carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium.
What is the SMILES notation for carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium?
The canonical SMILES for carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium is CC(C)[N-]C(C)[N-]C(C)C.[CH3-].[CH3-].[CH3-].[Zr].
What is the InChIKey of carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium?
The InChIKey is YDOPCAAFLPHHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.3CH3.Zr/c1-6(2)9-8(5)10-7(3)4;;;;/h6-8H,1-5H3;3*1H3;/q-2;3*-1;.
What are the key properties of carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium?
carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium has a molecular weight of 278.58 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;propan-2-yl(1-propan-2-ylazanidylethyl)azanide;zirconium is sourced from PubChem (CID 58635676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).