N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide

C20H15F2NOS — CID 17271870

IUPACN-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide
SMILESO=C(Nc1cc(F)cc(F)c1)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C20H15F2NOS/c21-15-11-16(22)13-17(12-15)23-20(24)19(14-7-3-1-4-8-14)25-18-9-5-2-6-10-18/h1-13,19H,(H,23,24)
InChIKeyYWNNJRYXTOKEOK-UHFFFAOYSA-N
MW355.41 g/mol
LogP5.44
Rot. Bonds5

About N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide

N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide (PubChem CID 17271870) has the molecular formula C20H15F2NOS and a molecular weight of 355.41 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide
PubChem CID17271870
Molecular FormulaC20H15F2NOS
Molecular Weight355.41 g/mol
Exact Mass355.08
IUPAC NameN-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide
SMILESO=C(Nc1cc(F)cc(F)c1)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C20H15F2NOS/c21-15-11-16(22)13-17(12-15)23-20(24)19(14-7-3-1-4-8-14)25-18-9-5-2-6-10-18/h1-13,19H,(H,23,24)
InChIKeyYWNNJRYXTOKEOK-UHFFFAOYSA-N
XLogP5.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.41
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N,2-diphenyl-2-phenylsulfanylacetamide
CID 821034
N,2-diphenyl-2-phenylsulfanylacetamide
CID 2885898
(2S)-N-(2,3,4,5,6-pentafluorophenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 2163801
N-(3-acetamidophenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 2904304
dimethyl 5-[(2-phenyl-2-phenylsulfanylacetyl)amino]benzene-1,3-dicarboxylate
CID 2862583
2-methyl-N-[4-[(2-phenyl-2-phenylsulfanylacetyl)amino]phenyl]propanamide
CID 43000405
2-methyl-N-[3-[(2-phenyl-2-phenylsulfanylacetyl)amino]phenyl]propanamide
CID 55609795
(2R)-N-(3-bromophenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 2268280
N-(2-chlorophenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 2904145
(2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-2-phenylsulfanylacetamide
CID 8896524
2-phenyl-2-phenylsulfanyl-N-pyrimidin-2-ylacetamide
CID 5196122
N-(2-hydroxyphenyl)-2-phenyl-2-phenylsulfanylacetamide
CID 42918814

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide?
The IUPAC name of N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide (CID 17271870) is N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide?
The canonical SMILES for N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide is O=C(Nc1cc(F)cc(F)c1)C(Sc1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide?
The InChIKey is YWNNJRYXTOKEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2NOS/c21-15-11-16(22)13-17(12-15)23-20(24)19(14-7-3-1-4-8-14)25-18-9-5-2-6-10-18/h1-13,19H,(H,23,24).
What are the key properties of N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide?
N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide has a molecular weight of 355.41 g/mol, XLogP of 5.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-2-phenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 17271870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).