N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide

C16H13FN2O4S — CID 66917809

IUPACN-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide
SMILESO=C(COc1cccc2[nH]ccc12)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C16H13FN2O4S/c17-11-4-6-12(7-5-11)24(21,22)19-16(20)10-23-15-3-1-2-14-13(15)8-9-18-14/h1-9,18H,10H2,(H,19,20)
InChIKeyGEMKLUPVCAZASY-UHFFFAOYSA-N
MW348.36 g/mol
LogP2.19
Rot. Bonds5

About N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide

N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide (PubChem CID 66917809) has the molecular formula C16H13FN2O4S and a molecular weight of 348.36 g/mol. Its IUPAC name is N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide
PubChem CID66917809
Molecular FormulaC16H13FN2O4S
Molecular Weight348.36 g/mol
Exact Mass348.06
IUPAC NameN-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide
SMILESO=C(COc1cccc2[nH]ccc12)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C16H13FN2O4S/c17-11-4-6-12(7-5-11)24(21,22)19-16(20)10-23-15-3-1-2-14-13(15)8-9-18-14/h1-9,18H,10H2,(H,19,20)
InChIKeyGEMKLUPVCAZASY-UHFFFAOYSA-N
XLogP2.19
TPSA88.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1H-indol-4-yloxy)-N-(2-phenylethyl)acetamide
CID 42506850
N-(2,4-dimethoxyphenyl)-2-(1H-indol-4-yloxy)acetamide
CID 29148471
2-(4-fluorophenyl)-N-(4-fluorophenyl)sulfonylacetamide
CID 56683687
2-hydroxy-3-(1H-indol-4-yloxy)propanoic acid
CID 13116553
N-(4-chlorophenyl)sulfonyl-2-(4-fluorophenyl)acetamide
CID 56673721
N-tert-butyl-2-[(1-oxo-2H-isoquinolin-5-yl)oxy]acetamide
CID 43985442
N-(4-fluorophenyl)-2-[(2-naphthalen-1-yloxyacetyl)amino]acetamide
CID 7851076
ethyl N-(4-fluorophenyl)sulfonylcarbamate
CID 19693765
N-[2-(1H-indol-4-yl)ethyl]-4-[(2-naphthalen-1-yloxyacetyl)amino]benzamide
CID 171059897
2-(2-fluorophenoxy)-N-[4-(methylsulfamoyl)phenyl]acetamide
CID 9219508
N-(4-chlorophenyl)sulfonyl-4-(2-fluorophenoxy)butanamide
CID 60552057
N-(4-bromophenyl)sulfonyl-2-(3-methylphenoxy)acetamide
CID 1034415

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide?
The IUPAC name of N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide (CID 66917809) is N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide?
The canonical SMILES for N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide is O=C(COc1cccc2[nH]ccc12)NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide?
The InChIKey is GEMKLUPVCAZASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O4S/c17-11-4-6-12(7-5-11)24(21,22)19-16(20)10-23-15-3-1-2-14-13(15)8-9-18-14/h1-9,18H,10H2,(H,19,20).
What are the key properties of N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide?
N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide has a molecular weight of 348.36 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)sulfonyl-2-(1H-indol-4-yloxy)acetamide is sourced from PubChem (CID 66917809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).