5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one

C18H19NO3 — CID 46887322

IUPAC5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one
SMILESCCc1cccc(OCC2CN(c3ccccc3)C(=O)O2)c1
InChIInChI=1S/C18H19NO3/c1-2-14-7-6-10-16(11-14)21-13-17-12-19(18(20)22-17)15-8-4-3-5-9-15/h3-11,17H,2,12-13H2,1H3
InChIKeyHNLZVQGMQBRBJO-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.65
Rot. Bonds5

About 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one

5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one (PubChem CID 46887322) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one
PubChem CID46887322
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one
SMILESCCc1cccc(OCC2CN(c3ccccc3)C(=O)O2)c1
InChIInChI=1S/C18H19NO3/c1-2-14-7-6-10-16(11-14)21-13-17-12-19(18(20)22-17)15-8-4-3-5-9-15/h3-11,17H,2,12-13H2,1H3
InChIKeyHNLZVQGMQBRBJO-UHFFFAOYSA-N
XLogP3.65
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one (CID 46887322) is 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one is CCc1cccc(OCC2CN(c3ccccc3)C(=O)O2)c1.
What is the InChIKey of 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one?
The InChIKey is HNLZVQGMQBRBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-2-14-7-6-10-16(11-14)21-13-17-12-19(18(20)22-17)15-8-4-3-5-9-15/h3-11,17H,2,12-13H2,1H3.
What are the key properties of 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one?
5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one has a molecular weight of 297.35 g/mol, XLogP of 3.65, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-ethylphenoxy)methyl]-3-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 46887322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).