2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide

C12H17ClN2O4S — CID 10853176

IUPAC2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide
SMILESCC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C12H17ClN2O4S/c1-9(2)7-15(8-12(16)14-17)20(18,19)11-5-3-10(13)4-6-11/h3-6,9,17H,7-8H2,1-2H3,(H,14,16)
InChIKeyKIVYTNANTFIVKL-UHFFFAOYSA-N
MW320.80 g/mol
LogP1.49
Rot. Bonds6

About 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide

2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide (PubChem CID 10853176) has the molecular formula C12H17ClN2O4S and a molecular weight of 320.80 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide
PubChem CID10853176
Molecular FormulaC12H17ClN2O4S
Molecular Weight320.80 g/mol
Exact Mass320.06
IUPAC Name2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide
SMILESCC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C12H17ClN2O4S/c1-9(2)7-15(8-12(16)14-17)20(18,19)11-5-3-10(13)4-6-11/h3-6,9,17H,7-8H2,1-2H3,(H,14,16)
InChIKeyKIVYTNANTFIVKL-UHFFFAOYSA-N
XLogP1.49
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.80
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide (CID 10853176) is 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide is CC(C)CN(CC(=O)NO)S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide?
The InChIKey is KIVYTNANTFIVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O4S/c1-9(2)7-15(8-12(16)14-17)20(18,19)11-5-3-10(13)4-6-11/h3-6,9,17H,7-8H2,1-2H3,(H,14,16).
What are the key properties of 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide?
2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide has a molecular weight of 320.80 g/mol, XLogP of 1.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonyl-(2-methylpropyl)amino]-N-hydroxyacetamide is sourced from PubChem (CID 10853176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).