2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide

C6H11N3O3 — CID 130710751

IUPAC2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide
SMILESNNC(=O)CN1CCCOC1=O
InChIInChI=1S/C6H11N3O3/c7-8-5(10)4-9-2-1-3-12-6(9)11/h1-4,7H2,(H,8,10)
InChIKeyDCCVNERIVPUZHO-UHFFFAOYSA-N
MW173.17 g/mol
LogP-1.18
Rot. Bonds2

About 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide

2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide (PubChem CID 130710751) has the molecular formula C6H11N3O3 and a molecular weight of 173.17 g/mol. Its IUPAC name is 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide.

Molecular Properties

Compound Name2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide
PubChem CID130710751
Molecular FormulaC6H11N3O3
Molecular Weight173.17 g/mol
Exact Mass173.08
IUPAC Name2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide
SMILESNNC(=O)CN1CCCOC1=O
InChIInChI=1S/C6H11N3O3/c7-8-5(10)4-9-2-1-3-12-6(9)11/h1-4,7H2,(H,8,10)
InChIKeyDCCVNERIVPUZHO-UHFFFAOYSA-N
XLogP-1.18
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 5-1.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide?
The IUPAC name of 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide (CID 130710751) is 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide.
What is the SMILES notation for 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide?
The canonical SMILES for 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide is NNC(=O)CN1CCCOC1=O.
What is the InChIKey of 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide?
The InChIKey is DCCVNERIVPUZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O3/c7-8-5(10)4-9-2-1-3-12-6(9)11/h1-4,7H2,(H,8,10).
What are the key properties of 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide?
2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide has a molecular weight of 173.17 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 2-(2-oxo-1,3-oxazinan-3-yl)acetohydrazide is sourced from PubChem (CID 130710751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).