N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide

C8H14N2O3 — CID 110872096

IUPACN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CCCOC1=O
InChIInChI=1S/C8H14N2O3/c1-7(11)9-3-5-10-4-2-6-13-8(10)12/h2-6H2,1H3,(H,9,11)
InChIKeyXORIKGKTBZTHEF-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.04
Rot. Bonds3

About N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide

N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide (PubChem CID 110872096) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide
PubChem CID110872096
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC NameN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide
SMILESCC(=O)NCCN1CCCOC1=O
InChIInChI=1S/C8H14N2O3/c1-7(11)9-3-5-10-4-2-6-13-8(10)12/h2-6H2,1H3,(H,9,11)
InChIKeyXORIKGKTBZTHEF-UHFFFAOYSA-N
XLogP-0.04
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide?
The IUPAC name of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide (CID 110872096) is N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide is CC(=O)NCCN1CCCOC1=O.
What is the InChIKey of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide?
The InChIKey is XORIKGKTBZTHEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-7(11)9-3-5-10-4-2-6-13-8(10)12/h2-6H2,1H3,(H,9,11).
What are the key properties of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide?
N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide has a molecular weight of 186.21 g/mol, XLogP of -0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]acetamide is sourced from PubChem (CID 110872096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).