potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate

C4H5KN2O3 — CID 173021686

IUPACpotassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate
SMILESCc1nnc(OC=O)o1.[H-].[K+]
InChIInChI=1S/C4H4N2O3.K.H/c1-3-5-6-4(9-3)8-2-7;;/h2H,1H3;;/q;+1;-1
InChIKeyRWSKDSOZFULIDR-UHFFFAOYSA-N
MW168.19 g/mol
LogP-2.97
Rot. Bonds2

About potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate

potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate (PubChem CID 173021686) has the molecular formula C4H5KN2O3 and a molecular weight of 168.19 g/mol. Its IUPAC name is potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate.

Molecular Properties

Compound Namepotassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate
PubChem CID173021686
Molecular FormulaC4H5KN2O3
Molecular Weight168.19 g/mol
Exact Mass167.99
IUPAC Namepotassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate
SMILESCc1nnc(OC=O)o1.[H-].[K+]
InChIInChI=1S/C4H4N2O3.K.H/c1-3-5-6-4(9-3)8-2-7;;/h2H,1H3;;/q;+1;-1
InChIKeyRWSKDSOZFULIDR-UHFFFAOYSA-N
XLogP-2.97
TPSA65.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 5-2.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate?
The IUPAC name of potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate (CID 173021686) is potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate.
What is the SMILES notation for potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate?
The canonical SMILES for potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate is Cc1nnc(OC=O)o1.[H-].[K+].
What is the InChIKey of potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate?
The InChIKey is RWSKDSOZFULIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2O3.K.H/c1-3-5-6-4(9-3)8-2-7;;/h2H,1H3;;/q;+1;-1.
What are the key properties of potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate?
potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate has a molecular weight of 168.19 g/mol, XLogP of -2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;(5-methyl-1,3,4-oxadiazol-2-yl) formate is sourced from PubChem (CID 173021686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).