azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride

C4H14Cl2N2O3 — CID 175251541

IUPACazane;N-ethoxy-N-hydroxyacetamide;dihydrochloride
SMILESCCON(O)C(C)=O.Cl.Cl.N
InChIInChI=1S/C4H9NO3.2ClH.H3N/c1-3-8-5(7)4(2)6;;;/h7H,3H2,1-2H3;2*1H;1H3
InChIKeyOVEKVDBZEUVFKM-UHFFFAOYSA-N
MW209.07 g/mol
LogP1.18
Rot. Bonds2

About azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride

azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride (PubChem CID 175251541) has the molecular formula C4H14Cl2N2O3 and a molecular weight of 209.07 g/mol. Its IUPAC name is azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride.

Molecular Properties

Compound Nameazane;N-ethoxy-N-hydroxyacetamide;dihydrochloride
PubChem CID175251541
Molecular FormulaC4H14Cl2N2O3
Molecular Weight209.07 g/mol
Exact Mass208.04
IUPAC Nameazane;N-ethoxy-N-hydroxyacetamide;dihydrochloride
SMILESCCON(O)C(C)=O.Cl.Cl.N
InChIInChI=1S/C4H9NO3.2ClH.H3N/c1-3-8-5(7)4(2)6;;;/h7H,3H2,1-2H3;2*1H;1H3
InChIKeyOVEKVDBZEUVFKM-UHFFFAOYSA-N
XLogP1.18
TPSA84.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.07
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethoxy-N-methylacetamide
CID 23617223
acetic acid;N,N-diethylacetamide
CID 174447974
ethyl acetate;dihydrochloride
CID 21477582
ethyl acetate;trihydrochloride
CID 141039771
ethyl N-acetyl-N-propanoylcarbamate
CID 121227334
ethyl N-acetyl-N-ethoxycarbonylcarbamate
CID 4688283
N-acetyl-N-methylbutanamide
CID 142271883
ethyl acetate;hydrochloride;hydroiodide
CID 174371987
1,1-diethoxyhydrazine
CID 160785529
ethyl 2-(dimethylamino)acetate;hydrochloride
CID 86629091
ethyl N,N-diaminocarbamate
CID 54365685
azane;carbonic acid;ethyl acetate
CID 175094152

Frequently Asked Questions

What is the IUPAC name of azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride?
The IUPAC name of azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride (CID 175251541) is azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride.
What is the SMILES notation for azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride?
The canonical SMILES for azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride is CCON(O)C(C)=O.Cl.Cl.N.
What is the InChIKey of azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride?
The InChIKey is OVEKVDBZEUVFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO3.2ClH.H3N/c1-3-8-5(7)4(2)6;;;/h7H,3H2,1-2H3;2*1H;1H3.
What are the key properties of azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride?
azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride has a molecular weight of 209.07 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N-ethoxy-N-hydroxyacetamide;dihydrochloride is sourced from PubChem (CID 175251541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).