azane;ethanamine;sulfuric acid

C2H14N2O8S2 — CID 173214245

IUPACazane;ethanamine;sulfuric acid
SMILESCCN.N.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/C2H7N.H3N.2H2O4S/c1-2-3;;2*1-5(2,3)4/h2-3H2,1H3;1H3;2*(H2,1,2,3,4)
InChIKeyVZLFYESKMOVBTC-UHFFFAOYSA-N
MW258.27 g/mol
LogP-1.18
Rot. Bonds

About azane;ethanamine;sulfuric acid

azane;ethanamine;sulfuric acid (PubChem CID 173214245) has the molecular formula C2H14N2O8S2 and a molecular weight of 258.27 g/mol. Its IUPAC name is azane;ethanamine;sulfuric acid.

Molecular Properties

Compound Nameazane;ethanamine;sulfuric acid
PubChem CID173214245
Molecular FormulaC2H14N2O8S2
Molecular Weight258.27 g/mol
Exact Mass258.02
IUPAC Nameazane;ethanamine;sulfuric acid
SMILESCCN.N.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/C2H7N.H3N.2H2O4S/c1-2-3;;2*1-5(2,3)4/h2-3H2,1H3;1H3;2*(H2,1,2,3,4)
InChIKeyVZLFYESKMOVBTC-UHFFFAOYSA-N
XLogP-1.18
TPSA210.22 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.27
LogP ≤ 5-1.18
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of azane;ethanamine;sulfuric acid?
The IUPAC name of azane;ethanamine;sulfuric acid (CID 173214245) is azane;ethanamine;sulfuric acid.
What is the SMILES notation for azane;ethanamine;sulfuric acid?
The canonical SMILES for azane;ethanamine;sulfuric acid is CCN.N.O=S(=O)(O)O.O=S(=O)(O)O.
What is the InChIKey of azane;ethanamine;sulfuric acid?
The InChIKey is VZLFYESKMOVBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N.H3N.2H2O4S/c1-2-3;;2*1-5(2,3)4/h2-3H2,1H3;1H3;2*(H2,1,2,3,4).
What are the key properties of azane;ethanamine;sulfuric acid?
azane;ethanamine;sulfuric acid has a molecular weight of 258.27 g/mol, XLogP of -1.18, 0 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azane;ethanamine;sulfuric acid is sourced from PubChem (CID 173214245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).