2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide

C10H14ClN3O3S — CID 54888759

IUPAC2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNS(=O)(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C10H14ClN3O3S/c1-14(2)10(15)6-13-18(16,17)9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3
InChIKeyUPUVBIKIJGECHE-UHFFFAOYSA-N
MW291.76 g/mol
LogP0.29
Rot. Bonds4

About 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide

2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide (PubChem CID 54888759) has the molecular formula C10H14ClN3O3S and a molecular weight of 291.76 g/mol. Its IUPAC name is 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide
PubChem CID54888759
Molecular FormulaC10H14ClN3O3S
Molecular Weight291.76 g/mol
Exact Mass291.04
IUPAC Name2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNS(=O)(=O)c1cc(Cl)ccc1N
InChIInChI=1S/C10H14ClN3O3S/c1-14(2)10(15)6-13-18(16,17)9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3
InChIKeyUPUVBIKIJGECHE-UHFFFAOYSA-N
XLogP0.29
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.76
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide 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

3-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylpropanamide
CID 61127654
3-[2-[(2-amino-5-chlorophenyl)sulfonylamino]ethyl]-1,1-dimethylurea
CID 83108543
2-amino-5-chloro-N-[2-(dimethylamino)propyl]benzenesulfonamide
CID 61127626
2,5-dichloro-3-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]benzoic acid
CID 43514531
2-[(3-amino-2,5-dimethylphenyl)sulfonylamino]-N,N-dimethylacetamide
CID 79889906
2-[(4-bromo-2-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide
CID 40753294
2-amino-5-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]benzenesulfonamide
CID 83108494
5-chloro-3-[[2-(dimethylamino)-2-oxoethyl]sulfamoyl]-2-fluorobenzoic acid
CID 43310943
ethyl 2-[(2-amino-4-chlorophenyl)sulfonylamino]acetate
CID 60812241
2-amino-5-chloro-N-(2-sulfamoylethyl)benzenesulfonamide
CID 54888381
2-amino-5-chloro-N-hexylbenzenesulfonamide
CID 61108372
2-amino-5-chloro-N-(2-hydroxy-4-methylpentyl)benzenesulfonamide
CID 107150851

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide (CID 54888759) is 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide is CN(C)C(=O)CNS(=O)(=O)c1cc(Cl)ccc1N.
What is the InChIKey of 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide?
The InChIKey is UPUVBIKIJGECHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O3S/c1-14(2)10(15)6-13-18(16,17)9-5-7(11)3-4-8(9)12/h3-5,13H,6,12H2,1-2H3.
What are the key properties of 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide?
2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide has a molecular weight of 291.76 g/mol, XLogP of 0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-5-chlorophenyl)sulfonylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 54888759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).