2-fluoro-2-phenylsulfanylacetamide

C8H8FNOS — CID 100930695

IUPAC2-fluoro-2-phenylsulfanylacetamide
SMILESNC(=O)C(F)Sc1ccccc1
InChIInChI=1S/C8H8FNOS/c9-7(8(10)11)12-6-4-2-1-3-5-6/h1-5,7H,(H2,10,11)
InChIKeyLHSMOUDAACFNGO-UHFFFAOYSA-N
MW185.22 g/mol
LogP1.56
Rot. Bonds3

About 2-fluoro-2-phenylsulfanylacetamide

2-fluoro-2-phenylsulfanylacetamide (PubChem CID 100930695) has the molecular formula C8H8FNOS and a molecular weight of 185.22 g/mol. Its IUPAC name is 2-fluoro-2-phenylsulfanylacetamide.

Molecular Properties

Compound Name2-fluoro-2-phenylsulfanylacetamide
PubChem CID100930695
Molecular FormulaC8H8FNOS
Molecular Weight185.22 g/mol
Exact Mass185.03
IUPAC Name2-fluoro-2-phenylsulfanylacetamide
SMILESNC(=O)C(F)Sc1ccccc1
InChIInChI=1S/C8H8FNOS/c9-7(8(10)11)12-6-4-2-1-3-5-6/h1-5,7H,(H2,10,11)
InChIKeyLHSMOUDAACFNGO-UHFFFAOYSA-N
XLogP1.56
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-carbamoyl-2-phenylsulfanylacetamide
CID 2470668
N-(2-(Phenylthio)ethyl)acetamide
CID 13250272
2-[(4-Fluorophenyl)thio]acetamide
CID 2407366
2-((2-Methylphenyl)thio)-acetamide
CID 36074
Acetamide, 2-(p-tolylthio)-
CID 51918
2-[(2-Fluorophenyl)sulfanyl]acetohydrazide
CID 4388854
(2E,4E)-N-hydroxy-6-phenylsulfanylhexa-2,4-dienamide
CID 11557720
3-(Phenylsulfanyl)propanehydrazide
CID 222880
2-(Phenylsulfinyl)acetamide
CID 12335699
3-(Benzenesulfonyl)propanamide
CID 853565
2,2,2-trifluoro-N-[methyl(phenyl)-lambda4-sulfanylidene]acetamide
CID 85968405
2-(Benzenesulfonyl)acetamide
CID 1810305

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-phenylsulfanylacetamide?
The IUPAC name of 2-fluoro-2-phenylsulfanylacetamide (CID 100930695) is 2-fluoro-2-phenylsulfanylacetamide.
What is the SMILES notation for 2-fluoro-2-phenylsulfanylacetamide?
The canonical SMILES for 2-fluoro-2-phenylsulfanylacetamide is NC(=O)C(F)Sc1ccccc1.
What is the InChIKey of 2-fluoro-2-phenylsulfanylacetamide?
The InChIKey is LHSMOUDAACFNGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNOS/c9-7(8(10)11)12-6-4-2-1-3-5-6/h1-5,7H,(H2,10,11).
What are the key properties of 2-fluoro-2-phenylsulfanylacetamide?
2-fluoro-2-phenylsulfanylacetamide has a molecular weight of 185.22 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-phenylsulfanylacetamide is sourced from PubChem (CID 100930695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).