[amino-(diacetyloxyamino)amino] acetate

C6H11N3O6 — CID 175234338

IUPAC[amino-(diacetyloxyamino)amino] acetate
SMILESCC(=O)ON(N)N(OC(C)=O)OC(C)=O
InChIInChI=1S/C6H11N3O6/c1-4(10)13-8(7)9(14-5(2)11)15-6(3)12/h7H2,1-3H3
InChIKeyFZTYKDQSQPQEIR-UHFFFAOYSA-N
MW221.17 g/mol
LogP-1.19
Rot. Bonds4

About [amino-(diacetyloxyamino)amino] acetate

[amino-(diacetyloxyamino)amino] acetate (PubChem CID 175234338) has the molecular formula C6H11N3O6 and a molecular weight of 221.17 g/mol. Its IUPAC name is [amino-(diacetyloxyamino)amino] acetate.

Molecular Properties

Compound Name[amino-(diacetyloxyamino)amino] acetate
PubChem CID175234338
Molecular FormulaC6H11N3O6
Molecular Weight221.17 g/mol
Exact Mass221.06
IUPAC Name[amino-(diacetyloxyamino)amino] acetate
SMILESCC(=O)ON(N)N(OC(C)=O)OC(C)=O
InChIInChI=1S/C6H11N3O6/c1-4(10)13-8(7)9(14-5(2)11)15-6(3)12/h7H2,1-3H3
InChIKeyFZTYKDQSQPQEIR-UHFFFAOYSA-N
XLogP-1.19
TPSA111.40 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.17
LogP ≤ 5-1.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [amino-(diacetyloxyamino)amino] acetate?
The IUPAC name of [amino-(diacetyloxyamino)amino] acetate (CID 175234338) is [amino-(diacetyloxyamino)amino] acetate.
What is the SMILES notation for [amino-(diacetyloxyamino)amino] acetate?
The canonical SMILES for [amino-(diacetyloxyamino)amino] acetate is CC(=O)ON(N)N(OC(C)=O)OC(C)=O.
What is the InChIKey of [amino-(diacetyloxyamino)amino] acetate?
The InChIKey is FZTYKDQSQPQEIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O6/c1-4(10)13-8(7)9(14-5(2)11)15-6(3)12/h7H2,1-3H3.
What are the key properties of [amino-(diacetyloxyamino)amino] acetate?
[amino-(diacetyloxyamino)amino] acetate has a molecular weight of 221.17 g/mol, XLogP of -1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [amino-(diacetyloxyamino)amino] acetate is sourced from PubChem (CID 175234338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).