2-(2-amino-5-ethoxyphenyl)sulfonylacetamide

C10H14N2O4S — CID 81176156

IUPAC2-(2-amino-5-ethoxyphenyl)sulfonylacetamide
SMILESCCOc1ccc(N)c(S(=O)(=O)CC(N)=O)c1
InChIInChI=1S/C10H14N2O4S/c1-2-16-7-3-4-8(11)9(5-7)17(14,15)6-10(12)13/h3-5H,2,6,11H2,1H3,(H2,12,13)
InChIKeyYHCFOJQXBHUWDP-UHFFFAOYSA-N
MW258.30 g/mol
LogP-0.07
Rot. Bonds5

About 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide

2-(2-amino-5-ethoxyphenyl)sulfonylacetamide (PubChem CID 81176156) has the molecular formula C10H14N2O4S and a molecular weight of 258.30 g/mol. Its IUPAC name is 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide.

Molecular Properties

Compound Name2-(2-amino-5-ethoxyphenyl)sulfonylacetamide
PubChem CID81176156
Molecular FormulaC10H14N2O4S
Molecular Weight258.30 g/mol
Exact Mass258.07
IUPAC Name2-(2-amino-5-ethoxyphenyl)sulfonylacetamide
SMILESCCOc1ccc(N)c(S(=O)(=O)CC(N)=O)c1
InChIInChI=1S/C10H14N2O4S/c1-2-16-7-3-4-8(11)9(5-7)17(14,15)6-10(12)13/h3-5H,2,6,11H2,1H3,(H2,12,13)
InChIKeyYHCFOJQXBHUWDP-UHFFFAOYSA-N
XLogP-0.07
TPSA112.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-amino-5-methoxyphenyl)sulfonylacetamide
CID 81207136
2-(2-amino-5-ethoxyphenyl)sulfonyl-N-ethylacetamide
CID 81175054
2-(2-amino-5-ethoxyphenyl)sulfonyl-N-(2-methylpropyl)acetamide
CID 81175778
4-ethoxy-2-(ethoxymethylsulfonyl)aniline
CID 81174679
4-ethoxy-2-(2-fluoroethylsulfonyl)aniline
CID 81176417
6-(2-amino-5-ethoxyphenyl)sulfonylhexan-1-ol
CID 107707390
4-ethoxy-2-(3-methylbutylsulfonyl)aniline
CID 81175786
2-(2-amino-5-fluorophenyl)sulfonylacetamide
CID 81182832
4-ethoxy-2-(4-methoxybutylsulfonyl)aniline
CID 104650980
4-ethoxy-2-[2-(trifluoromethoxy)ethylsulfonyl]aniline
CID 81174673
2-(2-amino-5-ethoxyphenyl)sulfonyl-N-propan-2-ylpropanamide
CID 81176298
4-ethoxy-2-(3-pyrrolidin-1-ylpropylsulfonyl)aniline
CID 81175150

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide?
The IUPAC name of 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide (CID 81176156) is 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide.
What is the SMILES notation for 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide?
The canonical SMILES for 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide is CCOc1ccc(N)c(S(=O)(=O)CC(N)=O)c1.
What is the InChIKey of 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide?
The InChIKey is YHCFOJQXBHUWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S/c1-2-16-7-3-4-8(11)9(5-7)17(14,15)6-10(12)13/h3-5H,2,6,11H2,1H3,(H2,12,13).
What are the key properties of 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide?
2-(2-amino-5-ethoxyphenyl)sulfonylacetamide has a molecular weight of 258.30 g/mol, XLogP of -0.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-ethoxyphenyl)sulfonylacetamide is sourced from PubChem (CID 81176156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).