dipotassium;cyclopentanolate;ethane;oxolan-3-olate

C11H22K2O3 — CID 156851295

IUPACdipotassium;cyclopentanolate;ethane;oxolan-3-olate
SMILESCC.[K+].[K+].[O-]C1CCCC1.[O-]C1CCOC1
InChIInChI=1S/C5H9O.C4H7O2.C2H6.2K/c6-5-3-1-2-4-5;5-4-1-2-6-3-4;1-2;;/h5H,1-4H2;4H,1-3H2;1-2H3;;/q2*-1;;2*+1
InChIKeyOKEYHSOFFLFDFL-UHFFFAOYSA-N
MW280.49 g/mol
LogP-5.54
Rot. Bonds

About dipotassium;cyclopentanolate;ethane;oxolan-3-olate

dipotassium;cyclopentanolate;ethane;oxolan-3-olate (PubChem CID 156851295) has the molecular formula C11H22K2O3 and a molecular weight of 280.49 g/mol. Its IUPAC name is dipotassium;cyclopentanolate;ethane;oxolan-3-olate.

Molecular Properties

Compound Namedipotassium;cyclopentanolate;ethane;oxolan-3-olate
PubChem CID156851295
Molecular FormulaC11H22K2O3
Molecular Weight280.49 g/mol
Exact Mass280.08
IUPAC Namedipotassium;cyclopentanolate;ethane;oxolan-3-olate
SMILESCC.[K+].[K+].[O-]C1CCCC1.[O-]C1CCOC1
InChIInChI=1S/C5H9O.C4H7O2.C2H6.2K/c6-5-3-1-2-4-5;5-4-1-2-6-3-4;1-2;;/h5H,1-4H2;4H,1-3H2;1-2H3;;/q2*-1;;2*+1
InChIKeyOKEYHSOFFLFDFL-UHFFFAOYSA-N
XLogP-5.54
TPSA55.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.49
LogP ≤ 5-5.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

potassium cyclooctanolate
CID 23713973
ethane;(3R)-oxolan-3-ol
CID 145226146
ethane;4-methyloxane;3-methyloxolane
CID 170734292
methyl(oxolan-3-yl)arsane
CID 173159758
(3S)-3-methyloxolane
CID 7857636
ethane;(3S)-3-methyloxane;sulfane
CID 158056662
methane;methylcyclobutane;3-methyloxolane
CID 160852925
N-cyclopentyloxolan-3-amine
CID 63331713
methylcyclohexane;3-methyloxane
CID 144617317
ethane;oxolane-3-carbaldehyde
CID 142909173
ethane;oxepane-3,5-diol
CID 176685419
ethane;methanol;oxepan-3-ol;propane
CID 176685478

Frequently Asked Questions

What is the IUPAC name of dipotassium;cyclopentanolate;ethane;oxolan-3-olate?
The IUPAC name of dipotassium;cyclopentanolate;ethane;oxolan-3-olate (CID 156851295) is dipotassium;cyclopentanolate;ethane;oxolan-3-olate.
What is the SMILES notation for dipotassium;cyclopentanolate;ethane;oxolan-3-olate?
The canonical SMILES for dipotassium;cyclopentanolate;ethane;oxolan-3-olate is CC.[K+].[K+].[O-]C1CCCC1.[O-]C1CCOC1.
What is the InChIKey of dipotassium;cyclopentanolate;ethane;oxolan-3-olate?
The InChIKey is OKEYHSOFFLFDFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9O.C4H7O2.C2H6.2K/c6-5-3-1-2-4-5;5-4-1-2-6-3-4;1-2;;/h5H,1-4H2;4H,1-3H2;1-2H3;;/q2*-1;;2*+1.
What are the key properties of dipotassium;cyclopentanolate;ethane;oxolan-3-olate?
dipotassium;cyclopentanolate;ethane;oxolan-3-olate has a molecular weight of 280.49 g/mol, XLogP of -5.54, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;cyclopentanolate;ethane;oxolan-3-olate is sourced from PubChem (CID 156851295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).