2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

C17H17N3O4S — CID 2714604

IUPAC2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESN#Cc1ccccc1OCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H17N3O4S/c18-11-14-3-1-2-4-16(14)24-12-17(21)20-10-9-13-5-7-15(8-6-13)25(19,22)23/h1-8H,9-10,12H2,(H,20,21)(H2,19,22,23)
InChIKeyAMYYEMWKFLQFLJ-UHFFFAOYSA-N
MW359.41 g/mol
LogP0.94
Rot. Bonds7

About 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (PubChem CID 2714604) has the molecular formula C17H17N3O4S and a molecular weight of 359.41 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
PubChem CID2714604
Molecular FormulaC17H17N3O4S
Molecular Weight359.41 g/mol
Exact Mass359.09
IUPAC Name2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
SMILESN#Cc1ccccc1OCC(=O)NCCc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H17N3O4S/c18-11-14-3-1-2-4-16(14)24-12-17(21)20-10-9-13-5-7-15(8-6-13)25(19,22)23/h1-8H,9-10,12H2,(H,20,21)(H2,19,22,23)
InChIKeyAMYYEMWKFLQFLJ-UHFFFAOYSA-N
XLogP0.94
TPSA122.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-cyanophenoxy)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 2565568
N-(2-aminoethyl)-2-(2-cyanophenoxy)acetamide
CID 12841749
2-(2-cyanophenoxy)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 26181302
2-(2-cyanophenoxy)-N-[2-(cyclohexen-1-yl)ethyl]acetamide
CID 2706736
2-(2-bromo-4-chlorophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2627423
2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 9141494
N-[(4-chlorophenyl)methyl]-2-(2-cyanophenoxy)acetamide
CID 2565510
3-amino-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 10707262
2-(4-chloro-2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2683015
methyl 3-chloro-4-[2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethoxy]benzoate
CID 55578270
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 26695506
2-(3-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 40613651

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide (CID 2714604) is 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is N#Cc1ccccc1OCC(=O)NCCc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is AMYYEMWKFLQFLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O4S/c18-11-14-3-1-2-4-16(14)24-12-17(21)20-10-9-13-5-7-15(8-6-13)25(19,22)23/h1-8H,9-10,12H2,(H,20,21)(H2,19,22,23).
What are the key properties of 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide?
2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 359.41 g/mol, XLogP of 0.94, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 2714604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).