2-phenoxy-N-(3-sulfamoylpropyl)acetamide

C11H16N2O4S — CID 47336951

IUPAC2-phenoxy-N-(3-sulfamoylpropyl)acetamide
SMILESNS(=O)(=O)CCCNC(=O)COc1ccccc1
InChIInChI=1S/C11H16N2O4S/c12-18(15,16)8-4-7-13-11(14)9-17-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,14)(H2,12,15,16)
InChIKeyLUWXSFJJNGPMAQ-UHFFFAOYSA-N
MW272.33 g/mol
LogP-0.14
Rot. Bonds7

About 2-phenoxy-N-(3-sulfamoylpropyl)acetamide

2-phenoxy-N-(3-sulfamoylpropyl)acetamide (PubChem CID 47336951) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 2-phenoxy-N-(3-sulfamoylpropyl)acetamide.

Molecular Properties

Compound Name2-phenoxy-N-(3-sulfamoylpropyl)acetamide
PubChem CID47336951
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name2-phenoxy-N-(3-sulfamoylpropyl)acetamide
SMILESNS(=O)(=O)CCCNC(=O)COc1ccccc1
InChIInChI=1S/C11H16N2O4S/c12-18(15,16)8-4-7-13-11(14)9-17-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,14)(H2,12,15,16)
InChIKeyLUWXSFJJNGPMAQ-UHFFFAOYSA-N
XLogP-0.14
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-phenoxy-N-(3-sulfamoylpropyl)acetamide 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

N-(4-acetamidobutyl)-2-phenoxyacetamide
CID 110358551
2-(4-bromophenoxy)-N-(3-phenoxypropyl)acetamide
CID 9245994
N-[2-(methylsulfamoyl)ethyl]-2-phenoxyacetamide
CID 110292880
N-(6-bromohexyl)-2-phenoxyacetamide
CID 114008509
2-(4-cyanophenoxy)-N-(2-sulfamoylethyl)acetamide
CID 43552443
N-(3-amino-3-sulfanylidenepropyl)-2-phenoxyacetamide
CID 62666698
N-hex-5-ynyl-2-phenoxyacetamide
CID 103758132
N-(8-oxononyl)-2-phenoxyacetamide
CID 157092159
N-[2-(benzylamino)ethyl]-2-phenoxyacetamide
CID 12876184
2-[(2-phenoxyacetyl)amino]ethyl 2-phenylacetate
CID 101151355
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
N-[4-(diethylamino)butyl]-2-phenoxyacetamide
CID 110442217

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(3-sulfamoylpropyl)acetamide?
The IUPAC name of 2-phenoxy-N-(3-sulfamoylpropyl)acetamide (CID 47336951) is 2-phenoxy-N-(3-sulfamoylpropyl)acetamide.
What is the SMILES notation for 2-phenoxy-N-(3-sulfamoylpropyl)acetamide?
The canonical SMILES for 2-phenoxy-N-(3-sulfamoylpropyl)acetamide is NS(=O)(=O)CCCNC(=O)COc1ccccc1.
What is the InChIKey of 2-phenoxy-N-(3-sulfamoylpropyl)acetamide?
The InChIKey is LUWXSFJJNGPMAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c12-18(15,16)8-4-7-13-11(14)9-17-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,14)(H2,12,15,16).
What are the key properties of 2-phenoxy-N-(3-sulfamoylpropyl)acetamide?
2-phenoxy-N-(3-sulfamoylpropyl)acetamide has a molecular weight of 272.33 g/mol, XLogP of -0.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(3-sulfamoylpropyl)acetamide is sourced from PubChem (CID 47336951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).