5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide

C11H18N2O5S — CID 104560023

IUPAC5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide
SMILESCOCCOCCOc1ccc(N)cc1S(N)(=O)=O
InChIInChI=1S/C11H18N2O5S/c1-16-4-5-17-6-7-18-10-3-2-9(12)8-11(10)19(13,14)15/h2-3,8H,4-7,12H2,1H3,(H2,13,14,15)
InChIKeyWHCPHDSYYIXXJN-UHFFFAOYSA-N
MW290.34 g/mol
LogP-0.04
Rot. Bonds8

About 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide

5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide (PubChem CID 104560023) has the molecular formula C11H18N2O5S and a molecular weight of 290.34 g/mol. Its IUPAC name is 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide.

Molecular Properties

Compound Name5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide
PubChem CID104560023
Molecular FormulaC11H18N2O5S
Molecular Weight290.34 g/mol
Exact Mass290.09
IUPAC Name5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide
SMILESCOCCOCCOc1ccc(N)cc1S(N)(=O)=O
InChIInChI=1S/C11H18N2O5S/c1-16-4-5-17-6-7-18-10-3-2-9(12)8-11(10)19(13,14)15/h2-3,8H,4-7,12H2,1H3,(H2,13,14,15)
InChIKeyWHCPHDSYYIXXJN-UHFFFAOYSA-N
XLogP-0.04
TPSA113.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-2-(2-methoxyethoxy)-N-methylbenzenesulfonamide
CID 103287723
5-amino-3-[2-(2-methoxyethoxy)ethoxy]-2-methylbenzenesulfonamide
CID 104559989
2-(2-ethoxyethoxy)-5-methylbenzenesulfonamide
CID 43457343
4-amino-2-[2-(2-methoxyethoxy)ethoxy]benzoic acid
CID 104564131
4-amino-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzoyl chloride
CID 102159784
4-[2-(3-methoxypropoxy)ethoxy]-2,3-dimethylbenzenesulfonamide
CID 103180943
4-(2-methoxyethoxy)-2,5-dimethylbenzenesulfonamide
CID 43164561
5-methyl-2-[2-(2,2,2-trifluoroethoxy)ethoxy]benzenesulfonamide
CID 61490332
3-amino-4-[2-(2-methoxyethoxy)ethoxy]-N-methylbenzenesulfonamide
CID 104559947
4-amino-N-ethyl-2-[2-(2-methoxyethoxy)ethoxy]benzamide
CID 104559956
3-methoxy-4-[3-(2-methoxyethoxy)propylsulfonyl]aniline
CID 103416112
3-chloro-4-[3-(2-methoxyethoxy)propoxy]benzenesulfonamide
CID 103410565

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide?
The IUPAC name of 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide (CID 104560023) is 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide.
What is the SMILES notation for 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide?
The canonical SMILES for 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide is COCCOCCOc1ccc(N)cc1S(N)(=O)=O.
What is the InChIKey of 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide?
The InChIKey is WHCPHDSYYIXXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O5S/c1-16-4-5-17-6-7-18-10-3-2-9(12)8-11(10)19(13,14)15/h2-3,8H,4-7,12H2,1H3,(H2,13,14,15).
What are the key properties of 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide?
5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide has a molecular weight of 290.34 g/mol, XLogP of -0.04, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[2-(2-methoxyethoxy)ethoxy]benzenesulfonamide is sourced from PubChem (CID 104560023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).