5-naphthalen-1-yl-1,3-oxazolidin-2-one

C13H11NO2 — CID 13152451

IUPAC5-naphthalen-1-yl-1,3-oxazolidin-2-one
SMILESO=C1NCC(c2cccc3ccccc23)O1
InChIInChI=1S/C13H11NO2/c15-13-14-8-12(16-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8H2,(H,14,15)
InChIKeyKQPCVDNHUXYORO-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.62
Rot. Bonds1

About 5-naphthalen-1-yl-1,3-oxazolidin-2-one

5-naphthalen-1-yl-1,3-oxazolidin-2-one (PubChem CID 13152451) has the molecular formula C13H11NO2 and a molecular weight of 213.24 g/mol. Its IUPAC name is 5-naphthalen-1-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-naphthalen-1-yl-1,3-oxazolidin-2-one
PubChem CID13152451
Molecular FormulaC13H11NO2
Molecular Weight213.24 g/mol
Exact Mass213.08
IUPAC Name5-naphthalen-1-yl-1,3-oxazolidin-2-one
SMILESO=C1NCC(c2cccc3ccccc23)O1
InChIInChI=1S/C13H11NO2/c15-13-14-8-12(16-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8H2,(H,14,15)
InChIKeyKQPCVDNHUXYORO-UHFFFAOYSA-N
XLogP2.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-yl-1,3-oxazolidin-2-one?
The IUPAC name of 5-naphthalen-1-yl-1,3-oxazolidin-2-one (CID 13152451) is 5-naphthalen-1-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-naphthalen-1-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-naphthalen-1-yl-1,3-oxazolidin-2-one is O=C1NCC(c2cccc3ccccc23)O1.
What is the InChIKey of 5-naphthalen-1-yl-1,3-oxazolidin-2-one?
The InChIKey is KQPCVDNHUXYORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO2/c15-13-14-8-12(16-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12H,8H2,(H,14,15).
What are the key properties of 5-naphthalen-1-yl-1,3-oxazolidin-2-one?
5-naphthalen-1-yl-1,3-oxazolidin-2-one has a molecular weight of 213.24 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-1-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 13152451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).