2-[(2-phenylphenyl)methylsulfinyl]acetamide

C15H15NO2S — CID 11694727

IUPAC2-[(2-phenylphenyl)methylsulfinyl]acetamide
SMILESNC(=O)CS(=O)Cc1ccccc1-c1ccccc1
InChIInChI=1S/C15H15NO2S/c16-15(17)11-19(18)10-13-8-4-5-9-14(13)12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,16,17)
InChIKeyIFSZLKPREALFKD-UHFFFAOYSA-N
MW273.36 g/mol
LogP2.09
Rot. Bonds5

About 2-[(2-phenylphenyl)methylsulfinyl]acetamide

2-[(2-phenylphenyl)methylsulfinyl]acetamide (PubChem CID 11694727) has the molecular formula C15H15NO2S and a molecular weight of 273.36 g/mol. Its IUPAC name is 2-[(2-phenylphenyl)methylsulfinyl]acetamide.

Molecular Properties

Compound Name2-[(2-phenylphenyl)methylsulfinyl]acetamide
PubChem CID11694727
Molecular FormulaC15H15NO2S
Molecular Weight273.36 g/mol
Exact Mass273.08
IUPAC Name2-[(2-phenylphenyl)methylsulfinyl]acetamide
SMILESNC(=O)CS(=O)Cc1ccccc1-c1ccccc1
InChIInChI=1S/C15H15NO2S/c16-15(17)11-19(18)10-13-8-4-5-9-14(13)12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,16,17)
InChIKeyIFSZLKPREALFKD-UHFFFAOYSA-N
XLogP2.09
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylphenyl)methylsulfinyl]acetamide?
The IUPAC name of 2-[(2-phenylphenyl)methylsulfinyl]acetamide (CID 11694727) is 2-[(2-phenylphenyl)methylsulfinyl]acetamide.
What is the SMILES notation for 2-[(2-phenylphenyl)methylsulfinyl]acetamide?
The canonical SMILES for 2-[(2-phenylphenyl)methylsulfinyl]acetamide is NC(=O)CS(=O)Cc1ccccc1-c1ccccc1.
What is the InChIKey of 2-[(2-phenylphenyl)methylsulfinyl]acetamide?
The InChIKey is IFSZLKPREALFKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2S/c16-15(17)11-19(18)10-13-8-4-5-9-14(13)12-6-2-1-3-7-12/h1-9H,10-11H2,(H2,16,17).
What are the key properties of 2-[(2-phenylphenyl)methylsulfinyl]acetamide?
2-[(2-phenylphenyl)methylsulfinyl]acetamide has a molecular weight of 273.36 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylphenyl)methylsulfinyl]acetamide is sourced from PubChem (CID 11694727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).