2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide

C16H16N2O4S — CID 151442310

IUPAC2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccccc2)c1CC1CNC(=O)O1
InChIInChI=1S/C16H16N2O4S/c17-23(20,21)15-8-4-7-13(11-5-2-1-3-6-11)14(15)9-12-10-18-16(19)22-12/h1-8,12H,9-10H2,(H,18,19)(H2,17,20,21)
InChIKeyPETVOZWPTNJWLS-UHFFFAOYSA-N
MW332.38 g/mol
LogP1.65
Rot. Bonds4

About 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide

2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide (PubChem CID 151442310) has the molecular formula C16H16N2O4S and a molecular weight of 332.38 g/mol. Its IUPAC name is 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide.

Molecular Properties

Compound Name2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide
PubChem CID151442310
Molecular FormulaC16H16N2O4S
Molecular Weight332.38 g/mol
Exact Mass332.08
IUPAC Name2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide
SMILESNS(=O)(=O)c1cccc(-c2ccccc2)c1CC1CNC(=O)O1
InChIInChI=1S/C16H16N2O4S/c17-23(20,21)15-8-4-7-13(11-5-2-1-3-6-11)14(15)9-12-10-18-16(19)22-12/h1-8,12H,9-10H2,(H,18,19)(H2,17,20,21)
InChIKeyPETVOZWPTNJWLS-UHFFFAOYSA-N
XLogP1.65
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.38
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide?
The IUPAC name of 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide (CID 151442310) is 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide.
What is the SMILES notation for 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide?
The canonical SMILES for 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide is NS(=O)(=O)c1cccc(-c2ccccc2)c1CC1CNC(=O)O1.
What is the InChIKey of 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide?
The InChIKey is PETVOZWPTNJWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4S/c17-23(20,21)15-8-4-7-13(11-5-2-1-3-6-11)14(15)9-12-10-18-16(19)22-12/h1-8,12H,9-10H2,(H,18,19)(H2,17,20,21).
What are the key properties of 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide?
2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide has a molecular weight of 332.38 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxo-1,3-oxazolidin-5-yl)methyl]-3-phenylbenzenesulfonamide is sourced from PubChem (CID 151442310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).