2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide

C14H12FNO2S — CID 71981299

IUPAC2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide
SMILESNC(=O)C(Sc1ccccc1O)c1ccc(F)cc1
InChIInChI=1S/C14H12FNO2S/c15-10-7-5-9(6-8-10)13(14(16)18)19-12-4-2-1-3-11(12)17/h1-8,13,17H,(H2,16,18)
InChIKeyMKQSBMXVVXUTDN-UHFFFAOYSA-N
MW277.32 g/mol
LogP2.85
Rot. Bonds4

About 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide

2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide (PubChem CID 71981299) has the molecular formula C14H12FNO2S and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide
PubChem CID71981299
Molecular FormulaC14H12FNO2S
Molecular Weight277.32 g/mol
Exact Mass277.06
IUPAC Name2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide
SMILESNC(=O)C(Sc1ccccc1O)c1ccc(F)cc1
InChIInChI=1S/C14H12FNO2S/c15-10-7-5-9(6-8-10)13(14(16)18)19-12-4-2-1-3-11(12)17/h1-8,13,17H,(H2,16,18)
InChIKeyMKQSBMXVVXUTDN-UHFFFAOYSA-N
XLogP2.85
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

(2R)-2-(4-fluorophenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide
CID 40809541
(2S)-2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-2-(4-fluorophenyl)acetamide
CID 42144517
2-(2,5-dimethylphenyl)sulfanyl-2-phenylacetamide
CID 18138315
2-(4-fluorophenyl)-2-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]sulfanylacetamide
CID 43040534
ethyl (2R)-2-(4-fluorophenyl)-2-(2-pyrrol-1-ylphenyl)sulfanylacetate
CID 129362435
ethyl 2-(4-fluorophenyl)-2-(2-pyrrol-1-ylphenyl)sulfanylacetate
CID 10021102
2-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide
CID 46690728
2-phenyl-2-pyrimidin-2-ylsulfanylacetamide
CID 18136130
2-[4-cyano-3-(trifluoromethyl)phenyl]sulfanyl-2-(4-fluorophenyl)acetamide
CID 146088281
(2R)-2-(4-fluorophenyl)-2-[3-(5-methyl-2-pyridinyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 41399900
2-(4-fluorophenyl)-2-[[5-(2-methoxyphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
CID 43040105
(2S)-2-(4-fluorophenyl)-2-[3-(4-methyl-2-pyridinyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 41399846

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide?
The IUPAC name of 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide (CID 71981299) is 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide?
The canonical SMILES for 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide is NC(=O)C(Sc1ccccc1O)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide?
The InChIKey is MKQSBMXVVXUTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO2S/c15-10-7-5-9(6-8-10)13(14(16)18)19-12-4-2-1-3-11(12)17/h1-8,13,17H,(H2,16,18).
What are the key properties of 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide?
2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide has a molecular weight of 277.32 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2-(2-hydroxyphenyl)sulfanylacetamide is sourced from PubChem (CID 71981299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).