3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one

C16H30N2O — CID 83238796

IUPAC3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC)N(C2CCCCCCC2)C1=O
InChIInChI=1S/C16H30N2O/c1-3-10-14-16(19)18(15(4-2)17-14)13-11-8-6-5-7-9-12-13/h13-15,17H,3-12H2,1-2H3
InChIKeyOQOXSDVTCAAOLP-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.44
Rot. Bonds4

About 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one

3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one (PubChem CID 83238796) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
PubChem CID83238796
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC)N(C2CCCCCCC2)C1=O
InChIInChI=1S/C16H30N2O/c1-3-10-14-16(19)18(15(4-2)17-14)13-11-8-6-5-7-9-12-13/h13-15,17H,3-12H2,1-2H3
InChIKeyOQOXSDVTCAAOLP-UHFFFAOYSA-N
XLogP3.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one?
The IUPAC name of 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one (CID 83238796) is 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one?
The canonical SMILES for 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one is CCCC1NC(CC)N(C2CCCCCCC2)C1=O.
What is the InChIKey of 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one?
The InChIKey is OQOXSDVTCAAOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-10-14-16(19)18(15(4-2)17-14)13-11-8-6-5-7-9-12-13/h13-15,17H,3-12H2,1-2H3.
What are the key properties of 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one?
3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one has a molecular weight of 266.43 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83238796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).