N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide

C14H11F2NOS — CID 956399

IUPACN-(2,6-difluorophenyl)-2-phenylsulfanylacetamide
SMILESO=C(CSc1ccccc1)Nc1c(F)cccc1F
InChIInChI=1S/C14H11F2NOS/c15-11-7-4-8-12(16)14(11)17-13(18)9-19-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,18)
InChIKeyUHQSUADRJANOKC-UHFFFAOYSA-N
MW279.31 g/mol
LogP3.70
Rot. Bonds4

About N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide

N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide (PubChem CID 956399) has the molecular formula C14H11F2NOS and a molecular weight of 279.31 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-phenylsulfanylacetamide
PubChem CID956399
Molecular FormulaC14H11F2NOS
Molecular Weight279.31 g/mol
Exact Mass279.05
IUPAC NameN-(2,6-difluorophenyl)-2-phenylsulfanylacetamide
SMILESO=C(CSc1ccccc1)Nc1c(F)cccc1F
InChIInChI=1S/C14H11F2NOS/c15-11-7-4-8-12(16)14(11)17-13(18)9-19-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,18)
InChIKeyUHQSUADRJANOKC-UHFFFAOYSA-N
XLogP3.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluorophenyl)-2-(4-fluorophenyl)sulfanylacetamide
CID 7284421
2-phenylsulfanyl-N-(2,4,6-trifluorophenyl)acetamide
CID 167825999
N-(2,6-dichlorophenyl)-2-phenylsulfanylacetamide
CID 963352
N-(4-fluorophenyl)-2-phenylsulfanylacetamide
CID 532041
N-(2,6-difluorophenyl)-2-(2,3,5,6-tetramethylphenyl)sulfanylacetamide
CID 7468628
2-(2,5-dichlorophenyl)sulfanyl-N-(2,6-difluorophenyl)acetamide
CID 2536490
N-(2,6-difluorophenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
CID 705223
N-(2,6-difluorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetamide
CID 7976693
N-(2,6-difluorophenyl)-2-(2,5-dimethylphenyl)sulfanylacetamide
CID 2616259
N-(2-hydroxyphenyl)-2-phenylsulfanylacetamide
CID 893908
2-phenylsulfanylacetohydrazide
CID 7037418
N-(2,6-difluorophenyl)-2-(4-methylquinolin-2-yl)sulfanylacetamide
CID 4800101

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide (CID 956399) is N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide is O=C(CSc1ccccc1)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide?
The InChIKey is UHQSUADRJANOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NOS/c15-11-7-4-8-12(16)14(11)17-13(18)9-19-10-5-2-1-3-6-10/h1-8H,9H2,(H,17,18).
What are the key properties of N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide?
N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide has a molecular weight of 279.31 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-phenylsulfanylacetamide is sourced from PubChem (CID 956399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).