N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide

C15H13F2NOS — CID 720215

IUPACN-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(SC(F)F)cc1
InChIInChI=1S/C15H13F2NOS/c16-15(17)20-13-8-6-12(7-9-13)18-14(19)10-11-4-2-1-3-5-11/h1-9,15H,10H2,(H,18,19)
InChIKeyKYTIPFIEVHQPMK-UHFFFAOYSA-N
MW293.34 g/mol
LogP4.18
Rot. Bonds5

About N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide

N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide (PubChem CID 720215) has the molecular formula C15H13F2NOS and a molecular weight of 293.34 g/mol. Its IUPAC name is N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide
PubChem CID720215
Molecular FormulaC15H13F2NOS
Molecular Weight293.34 g/mol
Exact Mass293.07
IUPAC NameN-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(SC(F)F)cc1
InChIInChI=1S/C15H13F2NOS/c16-15(17)20-13-8-6-12(7-9-13)18-14(19)10-11-4-2-1-3-5-11/h1-9,15H,10H2,(H,18,19)
InChIKeyKYTIPFIEVHQPMK-UHFFFAOYSA-N
XLogP4.18
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide?
The IUPAC name of N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide (CID 720215) is N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide is O=C(Cc1ccccc1)Nc1ccc(SC(F)F)cc1.
What is the InChIKey of N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide?
The InChIKey is KYTIPFIEVHQPMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2NOS/c16-15(17)20-13-8-6-12(7-9-13)18-14(19)10-11-4-2-1-3-5-11/h1-9,15H,10H2,(H,18,19).
What are the key properties of N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide?
N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide has a molecular weight of 293.34 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethylsulfanyl)phenyl]-2-phenylacetamide is sourced from PubChem (CID 720215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).