N-[1-(5-oxooxolan-2-yl)ethyl]acetamide

C8H13NO3 — CID 20736430

IUPACN-[1-(5-oxooxolan-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1CCC(=O)O1
InChIInChI=1S/C8H13NO3/c1-5(9-6(2)10)7-3-4-8(11)12-7/h5,7H,3-4H2,1-2H3,(H,9,10)
InChIKeyQEILXUAKQVKTAP-UHFFFAOYSA-N
MW171.20 g/mol
LogP0.22
Rot. Bonds2

About N-[1-(5-oxooxolan-2-yl)ethyl]acetamide

N-[1-(5-oxooxolan-2-yl)ethyl]acetamide (PubChem CID 20736430) has the molecular formula C8H13NO3 and a molecular weight of 171.20 g/mol. Its IUPAC name is N-[1-(5-oxooxolan-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(5-oxooxolan-2-yl)ethyl]acetamide
PubChem CID20736430
Molecular FormulaC8H13NO3
Molecular Weight171.20 g/mol
Exact Mass171.09
IUPAC NameN-[1-(5-oxooxolan-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1CCC(=O)O1
InChIInChI=1S/C8H13NO3/c1-5(9-6(2)10)7-3-4-8(11)12-7/h5,7H,3-4H2,1-2H3,(H,9,10)
InChIKeyQEILXUAKQVKTAP-UHFFFAOYSA-N
XLogP0.22
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(5-oxooxolan-2-yl)ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-oxooxolan-2-yl)ethyl]acetamide?
The IUPAC name of N-[1-(5-oxooxolan-2-yl)ethyl]acetamide (CID 20736430) is N-[1-(5-oxooxolan-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(5-oxooxolan-2-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(5-oxooxolan-2-yl)ethyl]acetamide is CC(=O)NC(C)C1CCC(=O)O1.
What is the InChIKey of N-[1-(5-oxooxolan-2-yl)ethyl]acetamide?
The InChIKey is QEILXUAKQVKTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO3/c1-5(9-6(2)10)7-3-4-8(11)12-7/h5,7H,3-4H2,1-2H3,(H,9,10).
What are the key properties of N-[1-(5-oxooxolan-2-yl)ethyl]acetamide?
N-[1-(5-oxooxolan-2-yl)ethyl]acetamide has a molecular weight of 171.20 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-oxooxolan-2-yl)ethyl]acetamide is sourced from PubChem (CID 20736430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).