sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde

C5H6NNaO3 — CID 173118852

IUPACsodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde
SMILESCc1nc(C=O)c(O)o1.[H-].[Na+]
InChIInChI=1S/C5H5NO3.Na.H/c1-3-6-4(2-7)5(8)9-3;;/h2,8H,1H3;;/q;+1;-1
InChIKeyRZDFAYQNYAQCFI-UHFFFAOYSA-N
MW151.10 g/mol
LogP-2.38
Rot. Bonds1

About sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde

sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde (PubChem CID 173118852) has the molecular formula C5H6NNaO3 and a molecular weight of 151.10 g/mol. Its IUPAC name is sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde.

Molecular Properties

Compound Namesodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde
PubChem CID173118852
Molecular FormulaC5H6NNaO3
Molecular Weight151.10 g/mol
Exact Mass151.02
IUPAC Namesodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde
SMILESCc1nc(C=O)c(O)o1.[H-].[Na+]
InChIInChI=1S/C5H5NO3.Na.H/c1-3-6-4(2-7)5(8)9-3;;/h2,8H,1H3;;/q;+1;-1
InChIKeyRZDFAYQNYAQCFI-UHFFFAOYSA-N
XLogP-2.38
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.10
LogP ≤ 5-2.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde 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 sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde?
The IUPAC name of sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde (CID 173118852) is sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde.
What is the SMILES notation for sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde?
The canonical SMILES for sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde is Cc1nc(C=O)c(O)o1.[H-].[Na+].
What is the InChIKey of sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde?
The InChIKey is RZDFAYQNYAQCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NO3.Na.H/c1-3-6-4(2-7)5(8)9-3;;/h2,8H,1H3;;/q;+1;-1.
What are the key properties of sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde?
sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde has a molecular weight of 151.10 g/mol, XLogP of -2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde is sourced from PubChem (CID 173118852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).