3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one

C13H24N2O2 — CID 83271242

IUPAC3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C2CCOC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(10-7-8-17-9-10)12(14-11)6-4-2/h10-12,14H,3-9H2,1-2H3
InChIKeyOBKBSJKQYPUEMU-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.50
Rot. Bonds5

About 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one

3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one (PubChem CID 83271242) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one
PubChem CID83271242
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(C2CCOC2)C1=O
InChIInChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(10-7-8-17-9-10)12(14-11)6-4-2/h10-12,14H,3-9H2,1-2H3
InChIKeyOBKBSJKQYPUEMU-UHFFFAOYSA-N
XLogP1.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one?
The IUPAC name of 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one (CID 83271242) is 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one?
The canonical SMILES for 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one is CCCC1NC(CCC)N(C2CCOC2)C1=O.
What is the InChIKey of 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one?
The InChIKey is OBKBSJKQYPUEMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-3-5-11-13(16)15(10-7-8-17-9-10)12(14-11)6-4-2/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one?
3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one has a molecular weight of 240.35 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one is sourced from PubChem (CID 83271242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).