potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide

C8H11KNO3- — CID 153295512

IUPACpotassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide
SMILESCC(C)(C)c1coc([C-]=O)n1.[K+].[OH-]
InChIInChI=1S/C8H10NO2.K.H2O/c1-8(2,3)6-5-11-7(4-10)9-6;;/h5H,1-3H3;;1H2/q-1;+1;/p-1
InChIKeyXQVIHXOEMNZNAB-UHFFFAOYSA-M
MW208.28 g/mol
LogP-1.74
Rot. Bonds1

About potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide

potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide (PubChem CID 153295512) has the molecular formula C8H11KNO3- and a molecular weight of 208.28 g/mol. Its IUPAC name is potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide.

Molecular Properties

Compound Namepotassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide
PubChem CID153295512
Molecular FormulaC8H11KNO3-
Molecular Weight208.28 g/mol
Exact Mass208.04
IUPAC Namepotassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide
SMILESCC(C)(C)c1coc([C-]=O)n1.[K+].[OH-]
InChIInChI=1S/C8H10NO2.K.H2O/c1-8(2,3)6-5-11-7(4-10)9-6;;/h5H,1-3H3;;1H2/q-1;+1;/p-1
InChIKeyXQVIHXOEMNZNAB-UHFFFAOYSA-M
XLogP-1.74
TPSA73.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-1.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide?
The IUPAC name of potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide (CID 153295512) is potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide.
What is the SMILES notation for potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide?
The canonical SMILES for potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide is CC(C)(C)c1coc([C-]=O)n1.[K+].[OH-].
What is the InChIKey of potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide?
The InChIKey is XQVIHXOEMNZNAB-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H10NO2.K.H2O/c1-8(2,3)6-5-11-7(4-10)9-6;;/h5H,1-3H3;;1H2/q-1;+1;/p-1.
What are the key properties of potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide?
potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide has a molecular weight of 208.28 g/mol, XLogP of -1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;(4-tert-butyl-1,3-oxazol-2-yl)methanone;hydroxide is sourced from PubChem (CID 153295512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).