ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))

C23H54NV15-3 — CID 161414455

IUPACethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))
SMILESC[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[NH-].[CH2-]C.[V+2].[V+2].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V]
InChIInChI=1S/5C4H9.C2H5.CH4N.15V/c5*1-4(2)3;2*1-2;;;;;;;;;;;;;;;/h5*1-3H3;1H2,2H3;2H,1H3;;;;;;;;;;;;;;;/q7*-1;;;;;;;;;;;;;;2*+2
InChIKeyPTFAFLSMRNDLBP-UHFFFAOYSA-N
MW1108.85 g/mol
LogP9.57
Rot. Bonds

About ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))

ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) (PubChem CID 161414455) has the molecular formula C23H54NV15-3 and a molecular weight of 1108.85 g/mol. Its IUPAC name is ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)).

Molecular Properties

Compound Nameethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))
PubChem CID161414455
Molecular FormulaC23H54NV15-3
Molecular Weight1108.85 g/mol
Exact Mass1108.59
IUPAC Nameethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))
SMILESC[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[NH-].[CH2-]C.[V+2].[V+2].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V]
InChIInChI=1S/5C4H9.C2H5.CH4N.15V/c5*1-4(2)3;2*1-2;;;;;;;;;;;;;;;/h5*1-3H3;1H2,2H3;2H,1H3;;;;;;;;;;;;;;;/q7*-1;;;;;;;;;;;;;;2*+2
InChIKeyPTFAFLSMRNDLBP-UHFFFAOYSA-N
XLogP9.57
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001108.85
LogP ≤ 59.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

carbanide;ethane;2-methylpropane;vanadium
CID 59877946
CID 161026813
CID 161026813
carbanide;ethane;2-methylpropane;tungsten
CID 177304586
ethane;methylazanide;zirconium(2+)
CID 154083360
ethane;methylazanide;tantalum(2+)
CID 87444383
ethane;hafnium;methylazanide
CID 154084666
fluoromethane;methane;2-methylpropane;vanadium(2+)
CID 161464000
ethane;iron(4+);hydrate
CID 172714198
cesium 2-methylpropane
CID 19086402
CID 135427175
CID 135427175
ethane;methane;2-methylpropane;propane;vanadium(2+)
CID 157138365
carbanide;bis(2-methylpropane);tungsten
CID 167353252

Frequently Asked Questions

What is the IUPAC name of ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))?
The IUPAC name of ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) (CID 161414455) is ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)).
What is the SMILES notation for ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))?
The canonical SMILES for ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) is C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[C-](C)C.C[NH-].[CH2-]C.[V+2].[V+2].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].[V].
What is the InChIKey of ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))?
The InChIKey is PTFAFLSMRNDLBP-UHFFFAOYSA-N. The full InChI is InChI=1S/5C4H9.C2H5.CH4N.15V/c5*1-4(2)3;2*1-2;;;;;;;;;;;;;;;/h5*1-3H3;1H2,2H3;2H,1H3;;;;;;;;;;;;;;;/q7*-1;;;;;;;;;;;;;;2*+2.
What are the key properties of ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))?
ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) has a molecular weight of 1108.85 g/mol, XLogP of 9.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+)) is sourced from PubChem (CID 161414455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).