sodium;hydride;piperidine;sulfuric acid

C5H14NNaO4S — CID 174391832

IUPACsodium;hydride;piperidine;sulfuric acid
SMILESC1CCNCC1.O=S(=O)(O)O.[H-].[Na+]
InChIInChI=1S/C5H11N.Na.H2O4S.H/c1-2-4-6-5-3-1;;1-5(2,3)4;/h6H,1-5H2;;(H2,1,2,3,4);/q;+1;;-1
InChIKeyOHCFRUARDILZIV-UHFFFAOYSA-N
MW207.23 g/mol
LogP-2.78
Rot. Bonds

About sodium;hydride;piperidine;sulfuric acid

sodium;hydride;piperidine;sulfuric acid (PubChem CID 174391832) has the molecular formula C5H14NNaO4S and a molecular weight of 207.23 g/mol. Its IUPAC name is sodium;hydride;piperidine;sulfuric acid.

Molecular Properties

Compound Namesodium;hydride;piperidine;sulfuric acid
PubChem CID174391832
Molecular FormulaC5H14NNaO4S
Molecular Weight207.23 g/mol
Exact Mass207.05
IUPAC Namesodium;hydride;piperidine;sulfuric acid
SMILESC1CCNCC1.O=S(=O)(O)O.[H-].[Na+]
InChIInChI=1S/C5H11N.Na.H2O4S.H/c1-2-4-6-5-3-1;;1-5(2,3)4;/h6H,1-5H2;;(H2,1,2,3,4);/q;+1;;-1
InChIKeyOHCFRUARDILZIV-UHFFFAOYSA-N
XLogP-2.78
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 5-2.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;hydride;piperidine;sulfuric acid?
The IUPAC name of sodium;hydride;piperidine;sulfuric acid (CID 174391832) is sodium;hydride;piperidine;sulfuric acid.
What is the SMILES notation for sodium;hydride;piperidine;sulfuric acid?
The canonical SMILES for sodium;hydride;piperidine;sulfuric acid is C1CCNCC1.O=S(=O)(O)O.[H-].[Na+].
What is the InChIKey of sodium;hydride;piperidine;sulfuric acid?
The InChIKey is OHCFRUARDILZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.Na.H2O4S.H/c1-2-4-6-5-3-1;;1-5(2,3)4;/h6H,1-5H2;;(H2,1,2,3,4);/q;+1;;-1.
What are the key properties of sodium;hydride;piperidine;sulfuric acid?
sodium;hydride;piperidine;sulfuric acid has a molecular weight of 207.23 g/mol, XLogP of -2.78, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;piperidine;sulfuric acid is sourced from PubChem (CID 174391832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).