1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one

C14H16N2O3 — CID 107684155

IUPAC1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one
SMILESO=C1CCc2cc(OCCN3CCNC3=O)ccc21
InChIInChI=1S/C14H16N2O3/c17-13-4-1-10-9-11(2-3-12(10)13)19-8-7-16-6-5-15-14(16)18/h2-3,9H,1,4-8H2,(H,15,18)
InChIKeyNOBJHYYROVGFFD-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.22
Rot. Bonds4

About 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one

1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one (PubChem CID 107684155) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one
PubChem CID107684155
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one
SMILESO=C1CCc2cc(OCCN3CCNC3=O)ccc21
InChIInChI=1S/C14H16N2O3/c17-13-4-1-10-9-11(2-3-12(10)13)19-8-7-16-6-5-15-14(16)18/h2-3,9H,1,4-8H2,(H,15,18)
InChIKeyNOBJHYYROVGFFD-UHFFFAOYSA-N
XLogP1.22
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one (CID 107684155) is 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one is O=C1CCc2cc(OCCN3CCNC3=O)ccc21.
What is the InChIKey of 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one?
The InChIKey is NOBJHYYROVGFFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c17-13-4-1-10-9-11(2-3-12(10)13)19-8-7-16-6-5-15-14(16)18/h2-3,9H,1,4-8H2,(H,15,18).
What are the key properties of 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one?
1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one has a molecular weight of 260.29 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1-oxo-2,3-dihydroinden-5-yl)oxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 107684155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).