2-(3-ethoxypropyl)imidazolidin-4-one

C8H16N2O2 — CID 123345095

IUPAC2-(3-ethoxypropyl)imidazolidin-4-one
SMILESCCOCCCC1NCC(=O)N1
InChIInChI=1S/C8H16N2O2/c1-2-12-5-3-4-7-9-6-8(11)10-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyQIEPFFBDBDGGPI-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.15
Rot. Bonds5

About 2-(3-ethoxypropyl)imidazolidin-4-one

2-(3-ethoxypropyl)imidazolidin-4-one (PubChem CID 123345095) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-(3-ethoxypropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(3-ethoxypropyl)imidazolidin-4-one
PubChem CID123345095
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-(3-ethoxypropyl)imidazolidin-4-one
SMILESCCOCCCC1NCC(=O)N1
InChIInChI=1S/C8H16N2O2/c1-2-12-5-3-4-7-9-6-8(11)10-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyQIEPFFBDBDGGPI-UHFFFAOYSA-N
XLogP-0.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(3-ethoxypropyl)imidazolidin-4-one 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 2-(3-ethoxypropyl)imidazolidin-4-one?
The IUPAC name of 2-(3-ethoxypropyl)imidazolidin-4-one (CID 123345095) is 2-(3-ethoxypropyl)imidazolidin-4-one.
What is the SMILES notation for 2-(3-ethoxypropyl)imidazolidin-4-one?
The canonical SMILES for 2-(3-ethoxypropyl)imidazolidin-4-one is CCOCCCC1NCC(=O)N1.
What is the InChIKey of 2-(3-ethoxypropyl)imidazolidin-4-one?
The InChIKey is QIEPFFBDBDGGPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-12-5-3-4-7-9-6-8(11)10-7/h7,9H,2-6H2,1H3,(H,10,11).
What are the key properties of 2-(3-ethoxypropyl)imidazolidin-4-one?
2-(3-ethoxypropyl)imidazolidin-4-one has a molecular weight of 172.23 g/mol, XLogP of -0.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxypropyl)imidazolidin-4-one is sourced from PubChem (CID 123345095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).