3-amino-5-ethyl-1,3-oxazolidine-2,4-dione

C5H8N2O3 — CID 122664066

IUPAC3-amino-5-ethyl-1,3-oxazolidine-2,4-dione
SMILESCCC1OC(=O)N(N)C1=O
InChIInChI=1S/C5H8N2O3/c1-2-3-4(8)7(6)5(9)10-3/h3H,2,6H2,1H3
InChIKeyJTGDKPJJUXKAFU-UHFFFAOYSA-N
MW144.13 g/mol
LogP-0.38
Rot. Bonds1

About 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione

3-amino-5-ethyl-1,3-oxazolidine-2,4-dione (PubChem CID 122664066) has the molecular formula C5H8N2O3 and a molecular weight of 144.13 g/mol. Its IUPAC name is 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name3-amino-5-ethyl-1,3-oxazolidine-2,4-dione
PubChem CID122664066
Molecular FormulaC5H8N2O3
Molecular Weight144.13 g/mol
Exact Mass144.05
IUPAC Name3-amino-5-ethyl-1,3-oxazolidine-2,4-dione
SMILESCCC1OC(=O)N(N)C1=O
InChIInChI=1S/C5H8N2O3/c1-2-3-4(8)7(6)5(9)10-3/h3H,2,6H2,1H3
InChIKeyJTGDKPJJUXKAFU-UHFFFAOYSA-N
XLogP-0.38
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione?
The IUPAC name of 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione (CID 122664066) is 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione is CCC1OC(=O)N(N)C1=O.
What is the InChIKey of 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione?
The InChIKey is JTGDKPJJUXKAFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O3/c1-2-3-4(8)7(6)5(9)10-3/h3H,2,6H2,1H3.
What are the key properties of 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione?
3-amino-5-ethyl-1,3-oxazolidine-2,4-dione has a molecular weight of 144.13 g/mol, XLogP of -0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-ethyl-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 122664066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).