2-ethoxyacetohydrazide;hydrochloride

C4H11ClN2O2 — CID 16641296

IUPAC2-ethoxyacetohydrazide;hydrochloride
SMILESCCOCC(=O)NN.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-2-8-3-4(7)6-5;/h2-3,5H2,1H3,(H,6,7);1H
InChIKeyQJHKFYAAHZNVJB-UHFFFAOYSA-N
MW154.60 g/mol
LogP-0.57
Rot. Bonds3

About 2-ethoxyacetohydrazide;hydrochloride

2-ethoxyacetohydrazide;hydrochloride (PubChem CID 16641296) has the molecular formula C4H11ClN2O2 and a molecular weight of 154.60 g/mol. Its IUPAC name is 2-ethoxyacetohydrazide;hydrochloride.

Molecular Properties

Compound Name2-ethoxyacetohydrazide;hydrochloride
PubChem CID16641296
Molecular FormulaC4H11ClN2O2
Molecular Weight154.60 g/mol
Exact Mass154.05
IUPAC Name2-ethoxyacetohydrazide;hydrochloride
SMILESCCOCC(=O)NN.Cl
InChIInChI=1S/C4H10N2O2.ClH/c1-2-8-3-4(7)6-5;/h2-3,5H2,1H3,(H,6,7);1H
InChIKeyQJHKFYAAHZNVJB-UHFFFAOYSA-N
XLogP-0.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 2-ethoxyacetohydrazide;hydrochloride?
The IUPAC name of 2-ethoxyacetohydrazide;hydrochloride (CID 16641296) is 2-ethoxyacetohydrazide;hydrochloride.
What is the SMILES notation for 2-ethoxyacetohydrazide;hydrochloride?
The canonical SMILES for 2-ethoxyacetohydrazide;hydrochloride is CCOCC(=O)NN.Cl.
What is the InChIKey of 2-ethoxyacetohydrazide;hydrochloride?
The InChIKey is QJHKFYAAHZNVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2.ClH/c1-2-8-3-4(7)6-5;/h2-3,5H2,1H3,(H,6,7);1H.
What are the key properties of 2-ethoxyacetohydrazide;hydrochloride?
2-ethoxyacetohydrazide;hydrochloride has a molecular weight of 154.60 g/mol, XLogP of -0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyacetohydrazide;hydrochloride is sourced from PubChem (CID 16641296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).