azane;bis(2-hydroxyethoxy)-oxoazanium

C4H13N2O5+ — CID 87262879

IUPACazane;bis(2-hydroxyethoxy)-oxoazanium
SMILESN.O=[N+](OCCO)OCCO
InChIInChI=1S/C4H10NO5.H3N/c6-1-3-9-5(8)10-4-2-7;/h6-7H,1-4H2;1H3/q+1;
InChIKeyUAFQYLSMLSERCK-UHFFFAOYSA-N
MW169.16 g/mol
LogP-1.22
Rot. Bonds6

About azane;bis(2-hydroxyethoxy)-oxoazanium

azane;bis(2-hydroxyethoxy)-oxoazanium (PubChem CID 87262879) has the molecular formula C4H13N2O5+ and a molecular weight of 169.16 g/mol. Its IUPAC name is azane;bis(2-hydroxyethoxy)-oxoazanium.

Molecular Properties

Compound Nameazane;bis(2-hydroxyethoxy)-oxoazanium
PubChem CID87262879
Molecular FormulaC4H13N2O5+
Molecular Weight169.16 g/mol
Exact Mass169.08
IUPAC Nameazane;bis(2-hydroxyethoxy)-oxoazanium
SMILESN.O=[N+](OCCO)OCCO
InChIInChI=1S/C4H10NO5.H3N/c6-1-3-9-5(8)10-4-2-7;/h6-7H,1-4H2;1H3/q+1;
InChIKeyUAFQYLSMLSERCK-UHFFFAOYSA-N
XLogP-1.22
TPSA114.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;bis(2-hydroxyethoxy)-oxoazanium?
The IUPAC name of azane;bis(2-hydroxyethoxy)-oxoazanium (CID 87262879) is azane;bis(2-hydroxyethoxy)-oxoazanium.
What is the SMILES notation for azane;bis(2-hydroxyethoxy)-oxoazanium?
The canonical SMILES for azane;bis(2-hydroxyethoxy)-oxoazanium is N.O=[N+](OCCO)OCCO.
What is the InChIKey of azane;bis(2-hydroxyethoxy)-oxoazanium?
The InChIKey is UAFQYLSMLSERCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10NO5.H3N/c6-1-3-9-5(8)10-4-2-7;/h6-7H,1-4H2;1H3/q+1;.
What are the key properties of azane;bis(2-hydroxyethoxy)-oxoazanium?
azane;bis(2-hydroxyethoxy)-oxoazanium has a molecular weight of 169.16 g/mol, XLogP of -1.22, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azane;bis(2-hydroxyethoxy)-oxoazanium is sourced from PubChem (CID 87262879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).