CID 161026813

C7H19K2V2-2 — CID 161026813

IUPAC—
SMILES[CH2-]C.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K].[V+2].[V]
InChIInChI=1S/2C2H5.3CH3.2K.2V/c2*1-2;;;;;;;/h2*1H2,2H3;3*1H3;;;;/q5*-1;;+1;;+2
InChIKeyLDEIHCPKXYAHQB-UHFFFAOYSA-N
MW283.31 g/mol
LogP-0.35
Rot. Bonds

About CID 161026813

CID 161026813 (PubChem CID 161026813) has the molecular formula C7H19K2V2-2 and a molecular weight of 283.31 g/mol.

Molecular Properties

Compound NameCID 161026813
PubChem CID161026813
Molecular FormulaC7H19K2V2-2
Molecular Weight283.31 g/mol
Exact Mass282.97
IUPAC Name—
SMILES[CH2-]C.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K].[V+2].[V]
InChIInChI=1S/2C2H5.3CH3.2K.2V/c2*1-2;;;;;;;/h2*1H2,2H3;3*1H3;;;;/q5*-1;;+1;;+2
InChIKeyLDEIHCPKXYAHQB-UHFFFAOYSA-N
XLogP-0.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.31
LogP ≤ 5-0.35
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

ethane;methylazanide;pentakis(2-methylpropane);tridecakis(vanadium);bis(vanadium(2+))
CID 161414455
carbanide;ethane;zirconium(4+)
CID 20781290
carbanide;ethane;zinc
CID 159908247
carbanide;ethane;zirconium
CID 173333588
carbanide;ethane;titanium(4+)
CID 15012447
carbanide;ethane;2-methylpropane;vanadium
CID 59877946
deuteriomethane;ethane;ethane;vanadium(2+)
CID 157055174
ethane;methylazanide;tantalum(2+)
CID 87444383
carbanide;ethane;methane;tetradecakis(yttrium)
CID 163542772
carbanide;ethane;methane;yttrium
CID 160665272
carbanide;ethane;pentakis(uranium(2+));uranium(3+)
CID 153312515
ethane;methylazanide;zirconium(2+)
CID 154083360

Frequently Asked Questions

What is the IUPAC name of CID 161026813?
The IUPAC name of CID 161026813 (CID 161026813) is not available.
What is the SMILES notation for CID 161026813?
The canonical SMILES for CID 161026813 is [CH2-]C.[CH2-]C.[CH3-].[CH3-].[CH3-].[K+].[K].[V+2].[V].
What is the InChIKey of CID 161026813?
The InChIKey is LDEIHCPKXYAHQB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5.3CH3.2K.2V/c2*1-2;;;;;;;/h2*1H2,2H3;3*1H3;;;;/q5*-1;;+1;;+2.
What are the key properties of CID 161026813?
CID 161026813 has a molecular weight of 283.31 g/mol, XLogP of -0.35, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 161026813 is sourced from PubChem (CID 161026813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).