5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one

C14H26N2O2 — CID 83248789

IUPAC5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC)C(=O)N1CCC1CCCO1
InChIInChI=1S/C14H26N2O2/c1-3-6-13-15-12(4-2)14(17)16(13)9-8-11-7-5-10-18-11/h11-13,15H,3-10H2,1-2H3
InChIKeyUZYQDNCBALAXRU-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.89
Rot. Bonds6

About 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one

5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one (PubChem CID 83248789) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
PubChem CID83248789
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC)C(=O)N1CCC1CCCO1
InChIInChI=1S/C14H26N2O2/c1-3-6-13-15-12(4-2)14(17)16(13)9-8-11-7-5-10-18-11/h11-13,15H,3-10H2,1-2H3
InChIKeyUZYQDNCBALAXRU-UHFFFAOYSA-N
XLogP1.89
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one (CID 83248789) is 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one is CCCC1NC(CC)C(=O)N1CCC1CCCO1.
What is the InChIKey of 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one?
The InChIKey is UZYQDNCBALAXRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-6-13-15-12(4-2)14(17)16(13)9-8-11-7-5-10-18-11/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one?
5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one has a molecular weight of 254.37 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one is sourced from PubChem (CID 83248789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).