4-(2-amino-2-methylpropyl)sulfonylphenol

C10H15NO3S — CID 115037318

IUPAC4-(2-amino-2-methylpropyl)sulfonylphenol
SMILESCC(C)(N)CS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C10H15NO3S/c1-10(2,11)7-15(13,14)9-5-3-8(12)4-6-9/h3-6,12H,7,11H2,1-2H3
InChIKeySJDXHWKJCPIAGQ-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.90
Rot. Bonds3

About 4-(2-amino-2-methylpropyl)sulfonylphenol

4-(2-amino-2-methylpropyl)sulfonylphenol (PubChem CID 115037318) has the molecular formula C10H15NO3S and a molecular weight of 229.30 g/mol. Its IUPAC name is 4-(2-amino-2-methylpropyl)sulfonylphenol.

Molecular Properties

Compound Name4-(2-amino-2-methylpropyl)sulfonylphenol
PubChem CID115037318
Molecular FormulaC10H15NO3S
Molecular Weight229.30 g/mol
Exact Mass229.08
IUPAC Name4-(2-amino-2-methylpropyl)sulfonylphenol
SMILESCC(C)(N)CS(=O)(=O)c1ccc(O)cc1
InChIInChI=1S/C10H15NO3S/c1-10(2,11)7-15(13,14)9-5-3-8(12)4-6-9/h3-6,12H,7,11H2,1-2H3
InChIKeySJDXHWKJCPIAGQ-UHFFFAOYSA-N
XLogP0.90
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(2-amino-2-methylpropyl)sulfonylphenol 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

4-(3-amino-2,2-dimethylpropyl)sulfonylphenol
CID 115045071
4-(2-hydroxy-2-methylpropyl)sulfonylphenol
CID 111435442
4-(chloromethylsulfonyl)phenol
CID 12707629
4-(3-amino-2-methylbutan-2-yl)sulfonylphenol
CID 115045054
4-[[4-[(4-hydroxyphenyl)methylsulfonyl]phenyl]sulfonylmethyl]phenol
CID 70503031
3-(4-ethylphenyl)sulfonyl-2,2-dimethylpropan-1-amine
CID 116853143
4-(2-fluoro-2-methylpropyl)sulfonylaniline
CID 84694579
4-pentylsulfonylphenol
CID 67000666
1-[4-[(4-hydroxyphenyl)sulfonylmethyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 156684459
CID 70636806
CID 70636806
4-(4-amino-4-methylpentan-2-yl)phenol
CID 83907598
4-[2-(4-methylphenyl)sulfonylethyl]phenol
CID 141218535

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-methylpropyl)sulfonylphenol?
The IUPAC name of 4-(2-amino-2-methylpropyl)sulfonylphenol (CID 115037318) is 4-(2-amino-2-methylpropyl)sulfonylphenol.
What is the SMILES notation for 4-(2-amino-2-methylpropyl)sulfonylphenol?
The canonical SMILES for 4-(2-amino-2-methylpropyl)sulfonylphenol is CC(C)(N)CS(=O)(=O)c1ccc(O)cc1.
What is the InChIKey of 4-(2-amino-2-methylpropyl)sulfonylphenol?
The InChIKey is SJDXHWKJCPIAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3S/c1-10(2,11)7-15(13,14)9-5-3-8(12)4-6-9/h3-6,12H,7,11H2,1-2H3.
What are the key properties of 4-(2-amino-2-methylpropyl)sulfonylphenol?
4-(2-amino-2-methylpropyl)sulfonylphenol has a molecular weight of 229.30 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-methylpropyl)sulfonylphenol is sourced from PubChem (CID 115037318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).