2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide

C16H17FN2O4S — CID 110660211

IUPAC2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide
SMILESO=C(COc1cccc(F)c1)NCCS(=O)(=O)Nc1ccccc1
InChIInChI=1S/C16H17FN2O4S/c17-13-5-4-8-15(11-13)23-12-16(20)18-9-10-24(21,22)19-14-6-2-1-3-7-14/h1-8,11,19H,9-10,12H2,(H,18,20)
InChIKeyIQLMOHUAAKEGOE-UHFFFAOYSA-N
MW352.39 g/mol
LogP1.76
Rot. Bonds8

About 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide

2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide (PubChem CID 110660211) has the molecular formula C16H17FN2O4S and a molecular weight of 352.39 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide
PubChem CID110660211
Molecular FormulaC16H17FN2O4S
Molecular Weight352.39 g/mol
Exact Mass352.09
IUPAC Name2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide
SMILESO=C(COc1cccc(F)c1)NCCS(=O)(=O)Nc1ccccc1
InChIInChI=1S/C16H17FN2O4S/c17-13-5-4-8-15(11-13)23-12-16(20)18-9-10-24(21,22)19-14-6-2-1-3-7-14/h1-8,11,19H,9-10,12H2,(H,18,20)
InChIKeyIQLMOHUAAKEGOE-UHFFFAOYSA-N
XLogP1.76
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
N-[2-(methylsulfamoyl)ethyl]-2-phenoxyacetamide
CID 110292880
5-[[2-(3-fluorophenoxy)acetyl]amino]pentanoic acid
CID 62032120
2-(3-fluorophenoxy)-N-pentylacetamide
CID 110756252
2-(3-fluorophenoxy)-N-(3-methoxypropyl)acetamide
CID 60626010
N-[2-(3,4-difluorophenyl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110788271
N-[2-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110718363
N-(4-bromophenyl)-3-[[2-(3-fluorophenoxy)acetyl]amino]propanamide
CID 47067523
2-(3-fluorophenoxy)-N-prop-2-ynylacetamide
CID 9008020
(2-anilino-2-oxoethyl) 2-(3-fluorophenoxy)acetate
CID 8915415
N-[2-(3-fluorophenoxy)ethyl]-2-phenylacetamide
CID 110483020
N-(2-bromoprop-2-enyl)-2-(3-fluorophenoxy)acetamide
CID 115594649

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide?
The IUPAC name of 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide (CID 110660211) is 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide?
The canonical SMILES for 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide is O=C(COc1cccc(F)c1)NCCS(=O)(=O)Nc1ccccc1.
What is the InChIKey of 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide?
The InChIKey is IQLMOHUAAKEGOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O4S/c17-13-5-4-8-15(11-13)23-12-16(20)18-9-10-24(21,22)19-14-6-2-1-3-7-14/h1-8,11,19H,9-10,12H2,(H,18,20).
What are the key properties of 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide?
2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide has a molecular weight of 352.39 g/mol, XLogP of 1.76, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-N-[2-(phenylsulfamoyl)ethyl]acetamide is sourced from PubChem (CID 110660211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).