2-phenyl-N-(2-phenylsulfanylphenyl)acetamide

C20H17NOS — CID 900782

IUPAC2-phenyl-N-(2-phenylsulfanylphenyl)acetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1Sc1ccccc1
InChIInChI=1S/C20H17NOS/c22-20(15-16-9-3-1-4-10-16)21-18-13-7-8-14-19(18)23-17-11-5-2-6-12-17/h1-14H,15H2,(H,21,22)
InChIKeyKOFSSDQVCBBJDO-UHFFFAOYSA-N
MW319.43 g/mol
LogP5.02
Rot. Bonds5

About 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide

2-phenyl-N-(2-phenylsulfanylphenyl)acetamide (PubChem CID 900782) has the molecular formula C20H17NOS and a molecular weight of 319.43 g/mol. Its IUPAC name is 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-phenyl-N-(2-phenylsulfanylphenyl)acetamide
PubChem CID900782
Molecular FormulaC20H17NOS
Molecular Weight319.43 g/mol
Exact Mass319.10
IUPAC Name2-phenyl-N-(2-phenylsulfanylphenyl)acetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1Sc1ccccc1
InChIInChI=1S/C20H17NOS/c22-20(15-16-9-3-1-4-10-16)21-18-13-7-8-14-19(18)23-17-11-5-2-6-12-17/h1-14H,15H2,(H,21,22)
InChIKeyKOFSSDQVCBBJDO-UHFFFAOYSA-N
XLogP5.02
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.43
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide?
The IUPAC name of 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide (CID 900782) is 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide?
The canonical SMILES for 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide is O=C(Cc1ccccc1)Nc1ccccc1Sc1ccccc1.
What is the InChIKey of 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide?
The InChIKey is KOFSSDQVCBBJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NOS/c22-20(15-16-9-3-1-4-10-16)21-18-13-7-8-14-19(18)23-17-11-5-2-6-12-17/h1-14H,15H2,(H,21,22).
What are the key properties of 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide?
2-phenyl-N-(2-phenylsulfanylphenyl)acetamide has a molecular weight of 319.43 g/mol, XLogP of 5.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-phenylsulfanylphenyl)acetamide is sourced from PubChem (CID 900782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).