2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide

C11H16ClN3O3S — CID 43567646

IUPAC2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNS(=O)(=O)c1cc(N)ccc1Cl
InChIInChI=1S/C11H16ClN3O3S/c1-7(2)15-11(16)6-14-19(17,18)10-5-8(13)3-4-9(10)12/h3-5,7,14H,6,13H2,1-2H3,(H,15,16)
InChIKeyAIWMXZRYXSZFFA-UHFFFAOYSA-N
MW305.79 g/mol
LogP0.73
Rot. Bonds5

About 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide

2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide (PubChem CID 43567646) has the molecular formula C11H16ClN3O3S and a molecular weight of 305.79 g/mol. Its IUPAC name is 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide
PubChem CID43567646
Molecular FormulaC11H16ClN3O3S
Molecular Weight305.79 g/mol
Exact Mass305.06
IUPAC Name2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNS(=O)(=O)c1cc(N)ccc1Cl
InChIInChI=1S/C11H16ClN3O3S/c1-7(2)15-11(16)6-14-19(17,18)10-5-8(13)3-4-9(10)12/h3-5,7,14H,6,13H2,1-2H3,(H,15,16)
InChIKeyAIWMXZRYXSZFFA-UHFFFAOYSA-N
XLogP0.73
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.79
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide 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

2-[(5-amino-2-fluorophenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 43567667
2-[(5-amino-2-ethylphenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 43567663
2-[(3-amino-4-bromo-5-chloro-2-fluorophenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 103077298
2-(5-amino-2-chlorophenyl)sulfonyl-N-propan-2-ylpropanamide
CID 81201760
5-amino-2-chloro-N-(4-hydroxybutan-2-yl)benzenesulfonamide
CID 83176400
5-amino-2-chloro-N-(4-hydroxy-2,2-dimethylbutyl)benzenesulfonamide
CID 106139709
N-(5-amino-2-chlorophenyl)sulfonylacetamide
CID 90103999
2-[(3-amino-5-chloro-4-methylphenyl)sulfonylamino]-N-propan-2-ylacetamide
CID 43567655
5-amino-2-chloro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]benzenesulfonamide
CID 79248425
5-amino-2-chloro-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)benzenesulfonamide
CID 106242782
5-amino-2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzenesulfonamide
CID 62991663
3-(5-amino-2-chlorophenyl)-N-propan-2-ylpropanamide
CID 172652013

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide (CID 43567646) is 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide is CC(C)NC(=O)CNS(=O)(=O)c1cc(N)ccc1Cl.
What is the InChIKey of 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide?
The InChIKey is AIWMXZRYXSZFFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O3S/c1-7(2)15-11(16)6-14-19(17,18)10-5-8(13)3-4-9(10)12/h3-5,7,14H,6,13H2,1-2H3,(H,15,16).
What are the key properties of 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide?
2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide has a molecular weight of 305.79 g/mol, XLogP of 0.73, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-2-chlorophenyl)sulfonylamino]-N-propan-2-ylacetamide is sourced from PubChem (CID 43567646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).