2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide

C10H15N3O3S — CID 43257083

IUPAC2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(N)=O)cc1N
InChIInChI=1S/C10H15N3O3S/c1-2-7-3-4-8(5-9(7)11)17(15,16)13-6-10(12)14/h3-5,13H,2,6,11H2,1H3,(H2,12,14)
InChIKeyCJTOZCOVUVBMGY-UHFFFAOYSA-N
MW257.31 g/mol
LogP-0.41
Rot. Bonds5

About 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide

2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide (PubChem CID 43257083) has the molecular formula C10H15N3O3S and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound Name2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide
PubChem CID43257083
Molecular FormulaC10H15N3O3S
Molecular Weight257.31 g/mol
Exact Mass257.08
IUPAC Name2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(N)=O)cc1N
InChIInChI=1S/C10H15N3O3S/c1-2-7-3-4-8(5-9(7)11)17(15,16)13-6-10(12)14/h3-5,13H,2,6,11H2,1H3,(H2,12,14)
InChIKeyCJTOZCOVUVBMGY-UHFFFAOYSA-N
XLogP-0.41
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 5-0.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(3-amino-4-ethylphenyl)sulfonylamino]ethoxy]acetamide
CID 106233792
3-amino-4-ethyl-N-(2-methylpropyl)benzenesulfonamide
CID 43256978
N-[2-[(3-amino-4-ethylphenyl)sulfonylamino]ethyl]acetamide
CID 43552681
2-[(4-aminophenyl)sulfonylamino]acetamide
CID 3678127
3-amino-N-(2,2-dimethylpropyl)-4-ethylbenzenesulfonamide
CID 61168643
methyl 3-[(3-amino-4-ethylphenyl)sulfonylamino]-2-hydroxypropanoate
CID 107213720
3-amino-4-ethyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
CID 79352793
2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 9189386
3-amino-4-ethyl-N-(3-methoxypropyl)benzenesulfonamide
CID 43258870
3-amino-N-(cyclopentylmethyl)-4-ethylbenzenesulfonamide
CID 43370862
3-amino-4-ethyl-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 60904241
3-amino-4-ethyl-N-[3-[methyl(propan-2-yl)amino]propyl]benzenesulfonamide
CID 106034450

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide?
The IUPAC name of 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide (CID 43257083) is 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide is CCc1ccc(S(=O)(=O)NCC(N)=O)cc1N.
What is the InChIKey of 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide?
The InChIKey is CJTOZCOVUVBMGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c1-2-7-3-4-8(5-9(7)11)17(15,16)13-6-10(12)14/h3-5,13H,2,6,11H2,1H3,(H2,12,14).
What are the key properties of 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide?
2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide has a molecular weight of 257.31 g/mol, XLogP of -0.41, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 43257083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).