N-(3-oxo-1,2-oxazolidin-4-yl)octanamide

C11H20N2O3 — CID 126506654

IUPACN-(3-oxo-1,2-oxazolidin-4-yl)octanamide
SMILESCCCCCCCC(=O)NC1CONC1=O
InChIInChI=1S/C11H20N2O3/c1-2-3-4-5-6-7-10(14)12-9-8-16-13-11(9)15/h9H,2-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyOHIQLDYPDWDODM-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.89
Rot. Bonds7

About N-(3-oxo-1,2-oxazolidin-4-yl)octanamide

N-(3-oxo-1,2-oxazolidin-4-yl)octanamide (PubChem CID 126506654) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-(3-oxo-1,2-oxazolidin-4-yl)octanamide.

Molecular Properties

Compound NameN-(3-oxo-1,2-oxazolidin-4-yl)octanamide
PubChem CID126506654
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-(3-oxo-1,2-oxazolidin-4-yl)octanamide
SMILESCCCCCCCC(=O)NC1CONC1=O
InChIInChI=1S/C11H20N2O3/c1-2-3-4-5-6-7-10(14)12-9-8-16-13-11(9)15/h9H,2-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyOHIQLDYPDWDODM-UHFFFAOYSA-N
XLogP0.89
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-oxo-1,2-oxazolidin-4-yl)octanamide?
The IUPAC name of N-(3-oxo-1,2-oxazolidin-4-yl)octanamide (CID 126506654) is N-(3-oxo-1,2-oxazolidin-4-yl)octanamide.
What is the SMILES notation for N-(3-oxo-1,2-oxazolidin-4-yl)octanamide?
The canonical SMILES for N-(3-oxo-1,2-oxazolidin-4-yl)octanamide is CCCCCCCC(=O)NC1CONC1=O.
What is the InChIKey of N-(3-oxo-1,2-oxazolidin-4-yl)octanamide?
The InChIKey is OHIQLDYPDWDODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-2-3-4-5-6-7-10(14)12-9-8-16-13-11(9)15/h9H,2-8H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N-(3-oxo-1,2-oxazolidin-4-yl)octanamide?
N-(3-oxo-1,2-oxazolidin-4-yl)octanamide has a molecular weight of 228.29 g/mol, XLogP of 0.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-oxo-1,2-oxazolidin-4-yl)octanamide is sourced from PubChem (CID 126506654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).