2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide

C14H12INO2S — CID 62000302

IUPAC2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide
SMILESO=C(CSc1ccccc1O)Nc1ccccc1I
InChIInChI=1S/C14H12INO2S/c15-10-5-1-2-6-11(10)16-14(18)9-19-13-8-4-3-7-12(13)17/h1-8,17H,9H2,(H,16,18)
InChIKeyXRSGYKXUIAQKAN-UHFFFAOYSA-N
MW385.23 g/mol
LogP3.73
Rot. Bonds4

About 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide

2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide (PubChem CID 62000302) has the molecular formula C14H12INO2S and a molecular weight of 385.23 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide
PubChem CID62000302
Molecular FormulaC14H12INO2S
Molecular Weight385.23 g/mol
Exact Mass384.96
IUPAC Name2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide
SMILESO=C(CSc1ccccc1O)Nc1ccccc1I
InChIInChI=1S/C14H12INO2S/c15-10-5-1-2-6-11(10)16-14(18)9-19-13-8-4-3-7-12(13)17/h1-8,17H,9H2,(H,16,18)
InChIKeyXRSGYKXUIAQKAN-UHFFFAOYSA-N
XLogP3.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.23
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(2-amino-3-methylphenyl)sulfanyl-N-(2-iodophenyl)acetamide
CID 79147398
2-(4-fluorophenyl)sulfanyl-N-(2-iodophenyl)acetamide
CID 2704723
2-benzylsulfanyl-N-(2-iodophenyl)acetamide
CID 4779995
N-(2-iodophenyl)-2-propylsulfanylacetamide
CID 87023608
N-(2-chlorophenyl)-2-(2-chlorophenyl)sulfanylacetamide
CID 2498952
4-[2-(2-iodoanilino)-2-oxoethyl]sulfanyl-3-nitrobenzamide
CID 26087611
2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
CID 4001438
N-(2-hydroxyphenyl)-2-phenylsulfanylacetamide
CID 893908
2-(1-ethylimidazol-2-yl)sulfanyl-N-(2-iodophenyl)acetamide
CID 42254906
N-(2-iodophenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 8707821
2-(2-hydroxyphenyl)sulfanyl-N-(2,4,6-trichlorophenyl)acetamide
CID 62000709
2-acetamido-N-(2-iodophenyl)acetamide
CID 60635742

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide (CID 62000302) is 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide is O=C(CSc1ccccc1O)Nc1ccccc1I.
What is the InChIKey of 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide?
The InChIKey is XRSGYKXUIAQKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12INO2S/c15-10-5-1-2-6-11(10)16-14(18)9-19-13-8-4-3-7-12(13)17/h1-8,17H,9H2,(H,16,18).
What are the key properties of 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide?
2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide has a molecular weight of 385.23 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)sulfanyl-N-(2-iodophenyl)acetamide is sourced from PubChem (CID 62000302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).