sodium;hydride;9-hydroxypurine

C5H5N4NaO — CID 174050509

IUPACsodium;hydride;9-hydroxypurine
SMILESOn1cnc2cncnc21.[H-].[Na+]
InChIInChI=1S/C5H4N4O.Na.H/c10-9-3-8-4-1-6-2-7-5(4)9;;/h1-3,10H;;/q;+1;-1
InChIKeyUCGZYDROPVCXBR-UHFFFAOYSA-N
MW160.11 g/mol
LogP-2.82
Rot. Bonds

About sodium;hydride;9-hydroxypurine

sodium;hydride;9-hydroxypurine (PubChem CID 174050509) has the molecular formula C5H5N4NaO and a molecular weight of 160.11 g/mol. Its IUPAC name is sodium;hydride;9-hydroxypurine.

Molecular Properties

Compound Namesodium;hydride;9-hydroxypurine
PubChem CID174050509
Molecular FormulaC5H5N4NaO
Molecular Weight160.11 g/mol
Exact Mass160.04
IUPAC Namesodium;hydride;9-hydroxypurine
SMILESOn1cnc2cncnc21.[H-].[Na+]
InChIInChI=1S/C5H4N4O.Na.H/c10-9-3-8-4-1-6-2-7-5(4)9;;/h1-3,10H;;/q;+1;-1
InChIKeyUCGZYDROPVCXBR-UHFFFAOYSA-N
XLogP-2.82
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.11
LogP ≤ 5-2.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze sodium;hydride;9-hydroxypurine 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;9-hydroxypurine?
The IUPAC name of sodium;hydride;9-hydroxypurine (CID 174050509) is sodium;hydride;9-hydroxypurine.
What is the SMILES notation for sodium;hydride;9-hydroxypurine?
The canonical SMILES for sodium;hydride;9-hydroxypurine is On1cnc2cncnc21.[H-].[Na+].
What is the InChIKey of sodium;hydride;9-hydroxypurine?
The InChIKey is UCGZYDROPVCXBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N4O.Na.H/c10-9-3-8-4-1-6-2-7-5(4)9;;/h1-3,10H;;/q;+1;-1.
What are the key properties of sodium;hydride;9-hydroxypurine?
sodium;hydride;9-hydroxypurine has a molecular weight of 160.11 g/mol, XLogP of -2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;9-hydroxypurine is sourced from PubChem (CID 174050509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).