5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione

C16H13NO4 — CID 13092012

IUPAC5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccccc2OCc2ccccc2)O1
InChIInChI=1S/C16H13NO4/c18-15-14(21-16(19)17-15)12-8-4-5-9-13(12)20-10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,18,19)
InChIKeyHPKGRYJVZDVIGV-UHFFFAOYSA-N
MW283.28 g/mol
LogP2.57
Rot. Bonds4

About 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione

5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione (PubChem CID 13092012) has the molecular formula C16H13NO4 and a molecular weight of 283.28 g/mol. Its IUPAC name is 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione
PubChem CID13092012
Molecular FormulaC16H13NO4
Molecular Weight283.28 g/mol
Exact Mass283.08
IUPAC Name5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2ccccc2OCc2ccccc2)O1
InChIInChI=1S/C16H13NO4/c18-15-14(21-16(19)17-15)12-8-4-5-9-13(12)20-10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,18,19)
InChIKeyHPKGRYJVZDVIGV-UHFFFAOYSA-N
XLogP2.57
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione (CID 13092012) is 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione is O=C1NC(=O)C(c2ccccc2OCc2ccccc2)O1.
What is the InChIKey of 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione?
The InChIKey is HPKGRYJVZDVIGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO4/c18-15-14(21-16(19)17-15)12-8-4-5-9-13(12)20-10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,18,19).
What are the key properties of 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione?
5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione has a molecular weight of 283.28 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenylmethoxyphenyl)-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 13092012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).