2-[(4-aminophenyl)sulfonylamino]acetamide

C8H11N3O3S — CID 3678127

IUPAC2-[(4-aminophenyl)sulfonylamino]acetamide
SMILESNC(=O)CNS(=O)(=O)c1ccc(N)cc1
InChIInChI=1S/C8H11N3O3S/c9-6-1-3-7(4-2-6)15(13,14)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12)
InChIKeyCUVOCAYVRNBSQZ-UHFFFAOYSA-N
MW229.26 g/mol
LogP-0.97
Rot. Bonds4

About 2-[(4-aminophenyl)sulfonylamino]acetamide

2-[(4-aminophenyl)sulfonylamino]acetamide (PubChem CID 3678127) has the molecular formula C8H11N3O3S and a molecular weight of 229.26 g/mol. Its IUPAC name is 2-[(4-aminophenyl)sulfonylamino]acetamide.

Molecular Properties

Compound Name2-[(4-aminophenyl)sulfonylamino]acetamide
PubChem CID3678127
Molecular FormulaC8H11N3O3S
Molecular Weight229.26 g/mol
Exact Mass229.05
IUPAC Name2-[(4-aminophenyl)sulfonylamino]acetamide
SMILESNC(=O)CNS(=O)(=O)c1ccc(N)cc1
InChIInChI=1S/C8H11N3O3S/c9-6-1-3-7(4-2-6)15(13,14)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12)
InChIKeyCUVOCAYVRNBSQZ-UHFFFAOYSA-N
XLogP-0.97
TPSA115.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 5-0.97
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-[(4-hydrazinylphenyl)sulfonylamino]acetamide
CID 43545768
2-[(4-tert-butylphenyl)sulfonylamino]acetamide
CID 9189386
2-[(4-cyanophenyl)sulfonylamino]acetamide
CID 4844985
2-[[4-(2-chloroethyl)phenyl]sulfonylamino]acetamide
CID 43662654
2-[(3-amino-4-ethylphenyl)sulfonylamino]acetamide
CID 43257083
tert-butyl 2-[(4-aminophenyl)sulfonylamino]acetate
CID 22456387
4-amino-N-(5-hydroxypentyl)benzenesulfonamide
CID 107316374
2-[(4-amino-2-bromophenyl)sulfonylamino]acetamide
CID 43255728
2-[(6-chloronaphthalen-2-yl)sulfonylamino]acetamide
CID 70140824
4-amino-N-ethylbenzenesulfonamide;molecular hydrogen
CID 143629087
3-(4-aminophenyl)sulfonylpropanamide
CID 61367837
4-amino-N-[2-[2-[(4-aminophenyl)sulfonylamino]ethylsulfonyl]ethyl]benzenesulfonamide
CID 141378845

Frequently Asked Questions

What is the IUPAC name of 2-[(4-aminophenyl)sulfonylamino]acetamide?
The IUPAC name of 2-[(4-aminophenyl)sulfonylamino]acetamide (CID 3678127) is 2-[(4-aminophenyl)sulfonylamino]acetamide.
What is the SMILES notation for 2-[(4-aminophenyl)sulfonylamino]acetamide?
The canonical SMILES for 2-[(4-aminophenyl)sulfonylamino]acetamide is NC(=O)CNS(=O)(=O)c1ccc(N)cc1.
What is the InChIKey of 2-[(4-aminophenyl)sulfonylamino]acetamide?
The InChIKey is CUVOCAYVRNBSQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3S/c9-6-1-3-7(4-2-6)15(13,14)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12).
What are the key properties of 2-[(4-aminophenyl)sulfonylamino]acetamide?
2-[(4-aminophenyl)sulfonylamino]acetamide has a molecular weight of 229.26 g/mol, XLogP of -0.97, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-aminophenyl)sulfonylamino]acetamide is sourced from PubChem (CID 3678127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).