3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one

C16H28N2O2 — CID 83263896

IUPAC3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one
SMILESO=C1CNC(C2CCCC2)N1CCOC1CCCCC1
InChIInChI=1S/C16H28N2O2/c19-15-12-17-16(13-6-4-5-7-13)18(15)10-11-20-14-8-2-1-3-9-14/h13-14,16-17H,1-12H2
InChIKeyVDPQTDURBALJNZ-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.28
Rot. Bonds5

About 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one

3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one (PubChem CID 83263896) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one
PubChem CID83263896
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one
SMILESO=C1CNC(C2CCCC2)N1CCOC1CCCCC1
InChIInChI=1S/C16H28N2O2/c19-15-12-17-16(13-6-4-5-7-13)18(15)10-11-20-14-8-2-1-3-9-14/h13-14,16-17H,1-12H2
InChIKeyVDPQTDURBALJNZ-UHFFFAOYSA-N
XLogP2.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one?
The IUPAC name of 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one (CID 83263896) is 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one.
What is the SMILES notation for 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one?
The canonical SMILES for 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one is O=C1CNC(C2CCCC2)N1CCOC1CCCCC1.
What is the InChIKey of 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one?
The InChIKey is VDPQTDURBALJNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c19-15-12-17-16(13-6-4-5-7-13)18(15)10-11-20-14-8-2-1-3-9-14/h13-14,16-17H,1-12H2.
What are the key properties of 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one?
3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one has a molecular weight of 280.41 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclohexyloxyethyl)-2-cyclopentylimidazolidin-4-one is sourced from PubChem (CID 83263896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).