N-hydroxy-2-naphthalen-2-ylsulfanylacetamide

C12H11NO2S — CID 11436221

IUPACN-hydroxy-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NO
InChIInChI=1S/C12H11NO2S/c14-12(13-15)8-16-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,15H,8H2,(H,13,14)
InChIKeyGNDJOJQVOFQQBM-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.44
Rot. Bonds3

About N-hydroxy-2-naphthalen-2-ylsulfanylacetamide

N-hydroxy-2-naphthalen-2-ylsulfanylacetamide (PubChem CID 11436221) has the molecular formula C12H11NO2S and a molecular weight of 233.29 g/mol. Its IUPAC name is N-hydroxy-2-naphthalen-2-ylsulfanylacetamide.

Molecular Properties

Compound NameN-hydroxy-2-naphthalen-2-ylsulfanylacetamide
PubChem CID11436221
Molecular FormulaC12H11NO2S
Molecular Weight233.29 g/mol
Exact Mass233.05
IUPAC NameN-hydroxy-2-naphthalen-2-ylsulfanylacetamide
SMILESO=C(CSc1ccc2ccccc2c1)NO
InChIInChI=1S/C12H11NO2S/c14-12(13-15)8-16-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,15H,8H2,(H,13,14)
InChIKeyGNDJOJQVOFQQBM-UHFFFAOYSA-N
XLogP2.44
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-hydroxy-2-naphthalen-2-ylsulfanylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-naphthalen-2-ylsulfanylacetamide?
The IUPAC name of N-hydroxy-2-naphthalen-2-ylsulfanylacetamide (CID 11436221) is N-hydroxy-2-naphthalen-2-ylsulfanylacetamide.
What is the SMILES notation for N-hydroxy-2-naphthalen-2-ylsulfanylacetamide?
The canonical SMILES for N-hydroxy-2-naphthalen-2-ylsulfanylacetamide is O=C(CSc1ccc2ccccc2c1)NO.
What is the InChIKey of N-hydroxy-2-naphthalen-2-ylsulfanylacetamide?
The InChIKey is GNDJOJQVOFQQBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2S/c14-12(13-15)8-16-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,15H,8H2,(H,13,14).
What are the key properties of N-hydroxy-2-naphthalen-2-ylsulfanylacetamide?
N-hydroxy-2-naphthalen-2-ylsulfanylacetamide has a molecular weight of 233.29 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-naphthalen-2-ylsulfanylacetamide is sourced from PubChem (CID 11436221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).