5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one

C16H16N2O2 — CID 655109

IUPAC5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(CN(c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C16H16N2O2/c19-16-17-11-15(20-16)12-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,17,19)
InChIKeySOFIFLFJWXPHMN-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.93
Rot. Bonds4

About 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one

5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one (PubChem CID 655109) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one
PubChem CID655109
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one
SMILESO=C1NCC(CN(c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C16H16N2O2/c19-16-17-11-15(20-16)12-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,17,19)
InChIKeySOFIFLFJWXPHMN-UHFFFAOYSA-N
XLogP2.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one (CID 655109) is 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one is O=C1NCC(CN(c2ccccc2)c2ccccc2)O1.
What is the InChIKey of 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one?
The InChIKey is SOFIFLFJWXPHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-16-17-11-15(20-16)12-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,17,19).
What are the key properties of 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one?
5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one has a molecular weight of 268.32 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(N-phenylanilino)methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 655109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).