potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide

C5H6KN2O3- — CID 176636050

IUPACpotassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide
SMILESCc1nnc(C[C-]=O)o1.[K+].[OH-]
InChIInChI=1S/C5H5N2O2.K.H2O/c1-4-6-7-5(9-4)2-3-8;;/h2H2,1H3;;1H2/q-1;+1;/p-1
InChIKeyYWGYFWDAZCBPJY-UHFFFAOYSA-M
MW181.21 g/mol
LogP-3.14
Rot. Bonds2

About potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide

potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide (PubChem CID 176636050) has the molecular formula C5H6KN2O3- and a molecular weight of 181.21 g/mol. Its IUPAC name is potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide.

Molecular Properties

Compound Namepotassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide
PubChem CID176636050
Molecular FormulaC5H6KN2O3-
Molecular Weight181.21 g/mol
Exact Mass181.00
IUPAC Namepotassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide
SMILESCc1nnc(C[C-]=O)o1.[K+].[OH-]
InChIInChI=1S/C5H5N2O2.K.H2O/c1-4-6-7-5(9-4)2-3-8;;/h2H2,1H3;;1H2/q-1;+1;/p-1
InChIKeyYWGYFWDAZCBPJY-UHFFFAOYSA-M
XLogP-3.14
TPSA85.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 5-3.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(chloromethyl)-5-methyl-1,3,4-oxadiazole;ethane
CID 145188643
sodium 2-(5-methyl-1,3,4-oxadiazol-2-yl)acetate
CID 135389336
3-methyl-1-(5-methyl-1,3,4-oxadiazol-2-yl)butan-2-one
CID 15582700
O-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]hydroxylamine
CID 59479251
(5-methyl-1,3,4-oxadiazol-2-yl)methylurea
CID 130738422
2,5-dimethyl-1,3,4-oxadiazole;propane
CID 143140950
2-[(4-fluorophenyl)sulfinylmethyl]-5-methyl-1,3,4-oxadiazole
CID 64716915
N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 25218857
N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanesulfonamide
CID 110318373
2-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)propanoic acid
CID 82125128
2-methyl-5-(propan-2-ylsulfanylmethyl)-1,3,4-oxadiazole
CID 110656410
2-methyl-5-[(2-methylpropan-2-yl)oxymethyl]-1,3,4-oxadiazole
CID 131179232

Frequently Asked Questions

What is the IUPAC name of potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide?
The IUPAC name of potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide (CID 176636050) is potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide.
What is the SMILES notation for potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide?
The canonical SMILES for potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide is Cc1nnc(C[C-]=O)o1.[K+].[OH-].
What is the InChIKey of potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide?
The InChIKey is YWGYFWDAZCBPJY-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H5N2O2.K.H2O/c1-4-6-7-5(9-4)2-3-8;;/h2H2,1H3;;1H2/q-1;+1;/p-1.
What are the key properties of potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide?
potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide has a molecular weight of 181.21 g/mol, XLogP of -3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-(5-methyl-1,3,4-oxadiazol-2-yl)ethanone;hydroxide is sourced from PubChem (CID 176636050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).