2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide

C10H14FN3O4S — CID 106239840

IUPAC2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide
SMILESNC(=O)COCCNc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C10H14FN3O4S/c11-8-5-7(19(13,16)17)1-2-9(8)14-3-4-18-6-10(12)15/h1-2,5,14H,3-4,6H2,(H2,12,15)(H2,13,16,17)
InChIKeyHYABLWMUQQGYLO-UHFFFAOYSA-N
MW291.30 g/mol
LogP-0.61
Rot. Bonds7

About 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide

2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide (PubChem CID 106239840) has the molecular formula C10H14FN3O4S and a molecular weight of 291.30 g/mol. Its IUPAC name is 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide
PubChem CID106239840
Molecular FormulaC10H14FN3O4S
Molecular Weight291.30 g/mol
Exact Mass291.07
IUPAC Name2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide
SMILESNC(=O)COCCNc1ccc(S(N)(=O)=O)cc1F
InChIInChI=1S/C10H14FN3O4S/c11-8-5-7(19(13,16)17)1-2-9(8)14-3-4-18-6-10(12)15/h1-2,5,14H,3-4,6H2,(H2,12,15)(H2,13,16,17)
InChIKeyHYABLWMUQQGYLO-UHFFFAOYSA-N
XLogP-0.61
TPSA124.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 5-0.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetic acid
CID 79457668
4-(2-ethoxyethylamino)-3-fluorobenzenesulfonamide
CID 60965986
3-fluoro-4-(propylamino)benzenesulfonamide
CID 60713095
3-fluoro-4-(4-hydroxybutylamino)benzenesulfonamide
CID 106842759
2-[2-(2-sulfamoylanilino)ethoxy]acetamide
CID 114162595
2-[2-(3-amino-5-sulfamoylanilino)ethoxy]acetamide
CID 106234438
3-fluoro-4-[2-(2-methoxyethylamino)ethylamino]benzenesulfonamide
CID 83029980
2-[2-(3-amino-4-sulfamoylanilino)ethoxy]acetamide
CID 106234450
2-[2-(2-amino-5-bromo-4-fluoroanilino)ethoxy]acetamide
CID 114161852
2-[2-(4-ethylsulfonylanilino)ethoxy]acetamide
CID 106239804
2-[2-(2-amino-3-fluoroanilino)ethoxy]acetamide
CID 106234436
2-[2-(2-cyano-4-fluoroanilino)ethoxy]acetamide
CID 106236966

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide?
The IUPAC name of 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide (CID 106239840) is 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide.
What is the SMILES notation for 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide?
The canonical SMILES for 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide is NC(=O)COCCNc1ccc(S(N)(=O)=O)cc1F.
What is the InChIKey of 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide?
The InChIKey is HYABLWMUQQGYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O4S/c11-8-5-7(19(13,16)17)1-2-9(8)14-3-4-18-6-10(12)15/h1-2,5,14H,3-4,6H2,(H2,12,15)(H2,13,16,17).
What are the key properties of 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide?
2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide has a molecular weight of 291.30 g/mol, XLogP of -0.61, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluoro-4-sulfamoylanilino)ethoxy]acetamide is sourced from PubChem (CID 106239840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).