N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide

C14H11ClFNOS — CID 2591754

IUPACN-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
SMILESO=C(CSc1ccccc1F)Nc1ccccc1Cl
InChIInChI=1S/C14H11ClFNOS/c15-10-5-1-3-7-12(10)17-14(18)9-19-13-8-4-2-6-11(13)16/h1-8H,9H2,(H,17,18)
InChIKeyJOSGZISMTPMMFA-UHFFFAOYSA-N
MW295.77 g/mol
LogP4.21
Rot. Bonds4

About N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide

N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide (PubChem CID 2591754) has the molecular formula C14H11ClFNOS and a molecular weight of 295.77 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
PubChem CID2591754
Molecular FormulaC14H11ClFNOS
Molecular Weight295.77 g/mol
Exact Mass295.02
IUPAC NameN-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
SMILESO=C(CSc1ccccc1F)Nc1ccccc1Cl
InChIInChI=1S/C14H11ClFNOS/c15-10-5-1-3-7-12(10)17-14(18)9-19-13-8-4-2-6-11(13)16/h1-8H,9H2,(H,17,18)
InChIKeyJOSGZISMTPMMFA-UHFFFAOYSA-N
XLogP4.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-2-(2-chlorophenyl)sulfanylacetamide
CID 2498952
[2-(2-chloroanilino)-2-oxoethyl] 2-(2-fluorophenyl)sulfanylacetate
CID 7355317
N-(2-amino-4-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
CID 29278790
N-(2-chlorophenyl)-2-(2,5-dimethylphenyl)sulfanylacetamide
CID 2616242
2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
CID 4001438
2-[[2-(2-chloroanilino)-2-oxoethyl]disulfanyl]-N-(2-chlorophenyl)acetamide
CID 71330084
N-[2-(cyanomethylsulfanyl)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 7484459
N-[2-(difluoromethoxy)phenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 2591520
2-(2-chlorophenyl)sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7761217
N-(2-chlorophenyl)-2-(2,3,5,6-tetrachlorophenyl)sulfanylacetamide
CID 2822568
N-(4-bromo-2-fluorophenyl)-2-(2-fluorophenyl)sulfanylacetamide
CID 16520358
N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)propanediamide
CID 108954936

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide?
The IUPAC name of N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide (CID 2591754) is N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide is O=C(CSc1ccccc1F)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide?
The InChIKey is JOSGZISMTPMMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNOS/c15-10-5-1-3-7-12(10)17-14(18)9-19-13-8-4-2-6-11(13)16/h1-8H,9H2,(H,17,18).
What are the key properties of N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide?
N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide has a molecular weight of 295.77 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(2-fluorophenyl)sulfanylacetamide is sourced from PubChem (CID 2591754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).