4-[dimethylsulfamoyl(methyl)amino]phenol

C9H14N2O3S — CID 686897

IUPAC4-[dimethylsulfamoyl(methyl)amino]phenol
SMILESCN(C)S(=O)(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C9H14N2O3S/c1-10(2)15(13,14)11(3)8-4-6-9(12)7-5-8/h4-7,12H,1-3H3
InChIKeyFTLSNMWDYINSEH-UHFFFAOYSA-N
MW230.29 g/mol
LogP0.63
Rot. Bonds3

About 4-[dimethylsulfamoyl(methyl)amino]phenol

4-[dimethylsulfamoyl(methyl)amino]phenol (PubChem CID 686897) has the molecular formula C9H14N2O3S and a molecular weight of 230.29 g/mol. Its IUPAC name is 4-[dimethylsulfamoyl(methyl)amino]phenol.

Molecular Properties

Compound Name4-[dimethylsulfamoyl(methyl)amino]phenol
PubChem CID686897
Molecular FormulaC9H14N2O3S
Molecular Weight230.29 g/mol
Exact Mass230.07
IUPAC Name4-[dimethylsulfamoyl(methyl)amino]phenol
SMILESCN(C)S(=O)(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C9H14N2O3S/c1-10(2)15(13,14)11(3)8-4-6-9(12)7-5-8/h4-7,12H,1-3H3
InChIKeyFTLSNMWDYINSEH-UHFFFAOYSA-N
XLogP0.63
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]phenol?
The IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]phenol (CID 686897) is 4-[dimethylsulfamoyl(methyl)amino]phenol.
What is the SMILES notation for 4-[dimethylsulfamoyl(methyl)amino]phenol?
The canonical SMILES for 4-[dimethylsulfamoyl(methyl)amino]phenol is CN(C)S(=O)(=O)N(C)c1ccc(O)cc1.
What is the InChIKey of 4-[dimethylsulfamoyl(methyl)amino]phenol?
The InChIKey is FTLSNMWDYINSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3S/c1-10(2)15(13,14)11(3)8-4-6-9(12)7-5-8/h4-7,12H,1-3H3.
What are the key properties of 4-[dimethylsulfamoyl(methyl)amino]phenol?
4-[dimethylsulfamoyl(methyl)amino]phenol has a molecular weight of 230.29 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dimethylsulfamoyl(methyl)amino]phenol is sourced from PubChem (CID 686897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).