dipotassium;2-methanidyl-3-methylbutane

C6H12K2 — CID 58795752

IUPACdipotassium;2-methanidyl-3-methylbutane
SMILES[CH2-]C([CH2-])C(C)C.[K+].[K+]
InChIInChI=1S/C6H12.2K/c1-5(2)6(3)4;;/h5-6H,1-2H2,3-4H3;;/q-2;2*+1
InChIKeyPAQRIFFZLVBJKM-UHFFFAOYSA-N
MW162.36 g/mol
LogP-4.07
Rot. Bonds1

About dipotassium;2-methanidyl-3-methylbutane

dipotassium;2-methanidyl-3-methylbutane (PubChem CID 58795752) has the molecular formula C6H12K2 and a molecular weight of 162.36 g/mol. Its IUPAC name is dipotassium;2-methanidyl-3-methylbutane.

Molecular Properties

Compound Namedipotassium;2-methanidyl-3-methylbutane
PubChem CID58795752
Molecular FormulaC6H12K2
Molecular Weight162.36 g/mol
Exact Mass162.02
IUPAC Namedipotassium;2-methanidyl-3-methylbutane
SMILES[CH2-]C([CH2-])C(C)C.[K+].[K+]
InChIInChI=1S/C6H12.2K/c1-5(2)6(3)4;;/h5-6H,1-2H2,3-4H3;;/q-2;2*+1
InChIKeyPAQRIFFZLVBJKM-UHFFFAOYSA-N
XLogP-4.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.36
LogP ≤ 5-4.07
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

2-methanidylpropane;decakis(yttrium)
CID 167360236
2-methanidylpropane;tungsten
CID 166592689
ethane;2-methanidylpropane;tungsten(2+)
CID 20607309
2-methanidylpropane;zirconium;trihydrochloride
CID 175005550
bis(2-methanidylpropane);titanium(2+);dihydrobromide
CID 175007215
zinc;2-methanidylpropane;bromide
CID 24942246
carbanide;2-methanidylpropane;bis(yttrium)
CID 161365817
2-methanidylpropane;titanium(4+);trichloride
CID 174197579
azanide;2-methanidylpropane;platinum(4+)
CID 153310938
sodium;2-methanidylpropane;hydroxide
CID 58205934
bis(2-methanidylpropane);zirconium(2+);dihydrate
CID 164789346
aluminum;bis(2-methanidylpropane);bromide
CID 11287466

Frequently Asked Questions

What is the IUPAC name of dipotassium;2-methanidyl-3-methylbutane?
The IUPAC name of dipotassium;2-methanidyl-3-methylbutane (CID 58795752) is dipotassium;2-methanidyl-3-methylbutane.
What is the SMILES notation for dipotassium;2-methanidyl-3-methylbutane?
The canonical SMILES for dipotassium;2-methanidyl-3-methylbutane is [CH2-]C([CH2-])C(C)C.[K+].[K+].
What is the InChIKey of dipotassium;2-methanidyl-3-methylbutane?
The InChIKey is PAQRIFFZLVBJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.2K/c1-5(2)6(3)4;;/h5-6H,1-2H2,3-4H3;;/q-2;2*+1.
What are the key properties of dipotassium;2-methanidyl-3-methylbutane?
dipotassium;2-methanidyl-3-methylbutane has a molecular weight of 162.36 g/mol, XLogP of -4.07, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;2-methanidyl-3-methylbutane is sourced from PubChem (CID 58795752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).