2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide

C17H17N3O4S — CID 9141494

IUPAC2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
SMILESCc1cc(S(N)(=O)=O)cc(NC(=O)COc2ccccc2C#N)c1C
InChIInChI=1S/C17H17N3O4S/c1-11-7-14(25(19,22)23)8-15(12(11)2)20-17(21)10-24-16-6-4-3-5-13(16)9-18/h3-8H,10H2,1-2H3,(H,20,21)(H2,19,22,23)
InChIKeyPYNDWVANTSFZFD-UHFFFAOYSA-N
MW359.41 g/mol
LogP1.84
Rot. Bonds5

About 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide

2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide (PubChem CID 9141494) has the molecular formula C17H17N3O4S and a molecular weight of 359.41 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
PubChem CID9141494
Molecular FormulaC17H17N3O4S
Molecular Weight359.41 g/mol
Exact Mass359.09
IUPAC Name2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
SMILESCc1cc(S(N)(=O)=O)cc(NC(=O)COc2ccccc2C#N)c1C
InChIInChI=1S/C17H17N3O4S/c1-11-7-14(25(19,22)23)8-15(12(11)2)20-17(21)10-24-16-6-4-3-5-13(16)9-18/h3-8H,10H2,1-2H3,(H,20,21)(H2,19,22,23)
InChIKeyPYNDWVANTSFZFD-UHFFFAOYSA-N
XLogP1.84
TPSA122.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(2-fluorophenoxy)acetamide
CID 9141447
2-(2-cyanophenoxy)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]acetamide
CID 7382540
2-(2-cyanophenoxy)-N-(4,5-dimethoxy-2-methylphenyl)acetamide
CID 42085793
methyl 3-[[2-(2-cyanophenoxy)acetyl]amino]-4-methylbenzoate
CID 7382502
2-(4-bromophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 9141449
N-[2-chloro-5-(diethylsulfamoyl)phenyl]-2-(2-cyanophenoxy)acetamide
CID 4779757
N-(3-bromo-4-methylphenyl)-2-(2-cyanophenoxy)acetamide
CID 7382555
2-[[2-(2-cyanophenoxy)acetyl]amino]benzamide
CID 7560509
2-(2-cyanophenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2714604
2-(2-cyanophenoxy)-N-(3-iodo-4-methylphenyl)acetamide
CID 8874271
2-(2-cyanophenoxy)-N-(4-fluoro-3-methylphenyl)acetamide
CID 62812512
N-(2,3-dimethyl-5-sulfamoylphenyl)-4-phenoxybutanamide
CID 9141472

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide (CID 9141494) is 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide is Cc1cc(S(N)(=O)=O)cc(NC(=O)COc2ccccc2C#N)c1C.
What is the InChIKey of 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide?
The InChIKey is PYNDWVANTSFZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O4S/c1-11-7-14(25(19,22)23)8-15(12(11)2)20-17(21)10-24-16-6-4-3-5-13(16)9-18/h3-8H,10H2,1-2H3,(H,20,21)(H2,19,22,23).
What are the key properties of 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide?
2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide has a molecular weight of 359.41 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide is sourced from PubChem (CID 9141494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).