2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide

C10H12F2N2O4S — CID 82914724

IUPAC2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide
SMILESCCNC(=O)COc1ccc(S(N)(=O)=O)c(F)c1F
InChIInChI=1S/C10H12F2N2O4S/c1-2-14-8(15)5-18-6-3-4-7(19(13,16)17)10(12)9(6)11/h3-4H,2,5H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeySAAWHKOQIWGYGT-UHFFFAOYSA-N
MW294.28 g/mol
LogP0.13
Rot. Bonds5

About 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide

2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide (PubChem CID 82914724) has the molecular formula C10H12F2N2O4S and a molecular weight of 294.28 g/mol. Its IUPAC name is 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide.

Molecular Properties

Compound Name2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide
PubChem CID82914724
Molecular FormulaC10H12F2N2O4S
Molecular Weight294.28 g/mol
Exact Mass294.05
IUPAC Name2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide
SMILESCCNC(=O)COc1ccc(S(N)(=O)=O)c(F)c1F
InChIInChI=1S/C10H12F2N2O4S/c1-2-14-8(15)5-18-6-3-4-7(19(13,16)17)10(12)9(6)11/h3-4H,2,5H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeySAAWHKOQIWGYGT-UHFFFAOYSA-N
XLogP0.13
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-difluoro-4-sulfamoylphenoxy)-N,N-diethylacetamide
CID 82917581
2-(4-bromo-2-sulfamoylphenoxy)-N-ethylacetamide
CID 82914401
4-(2,3-difluoro-4-sulfamoylphenoxy)-N-methylbutanamide
CID 82914648
2-(2,5-dichloro-4-sulfamoylphenoxy)-N-ethylacetamide
CID 82913877
2-(2-chloro-4-sulfamoylphenoxy)-N-ethylacetamide
CID 82921286
3-(2,3-difluoro-4-sulfamoylphenoxy)propanamide
CID 82915236
4-[2-(carbamoylamino)-2-oxoethoxy]-2,3-difluorobenzenesulfonyl chloride
CID 82920937
2-(2,3-dichloro-4-sulfamoylphenoxy)-N-methylacetamide
CID 82911048
4-[2-(ethylamino)-2-oxoethoxy]-3-fluorobenzenesulfonyl chloride
CID 82917384
2-(4-fluoro-2-sulfamoylphenoxy)-N-(2,2,2-trifluoroethyl)acetamide
CID 82917421
2-(2,3-dimethyl-4-sulfamoylphenoxy)-N-(2-methoxyethyl)acetamide
CID 82913296
N-(cyclopropylmethyl)-2-(2,3-dimethyl-4-sulfamoylphenoxy)acetamide
CID 82913298

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide?
The IUPAC name of 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide (CID 82914724) is 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide.
What is the SMILES notation for 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide?
The canonical SMILES for 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide is CCNC(=O)COc1ccc(S(N)(=O)=O)c(F)c1F.
What is the InChIKey of 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide?
The InChIKey is SAAWHKOQIWGYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O4S/c1-2-14-8(15)5-18-6-3-4-7(19(13,16)17)10(12)9(6)11/h3-4H,2,5H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide?
2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide has a molecular weight of 294.28 g/mol, XLogP of 0.13, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluoro-4-sulfamoylphenoxy)-N-ethylacetamide is sourced from PubChem (CID 82914724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).