4-[diethylsulfamoyl(methyl)amino]phenol

C11H18N2O3S — CID 28785528

IUPAC4-[diethylsulfamoyl(methyl)amino]phenol
SMILESCCN(CC)S(=O)(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C11H18N2O3S/c1-4-13(5-2)17(15,16)12(3)10-6-8-11(14)9-7-10/h6-9,14H,4-5H2,1-3H3
InChIKeyIDTPHEQQHQUBTF-UHFFFAOYSA-N
MW258.34 g/mol
LogP1.41
Rot. Bonds5

About 4-[diethylsulfamoyl(methyl)amino]phenol

4-[diethylsulfamoyl(methyl)amino]phenol (PubChem CID 28785528) has the molecular formula C11H18N2O3S and a molecular weight of 258.34 g/mol. Its IUPAC name is 4-[diethylsulfamoyl(methyl)amino]phenol.

Molecular Properties

Compound Name4-[diethylsulfamoyl(methyl)amino]phenol
PubChem CID28785528
Molecular FormulaC11H18N2O3S
Molecular Weight258.34 g/mol
Exact Mass258.10
IUPAC Name4-[diethylsulfamoyl(methyl)amino]phenol
SMILESCCN(CC)S(=O)(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C11H18N2O3S/c1-4-13(5-2)17(15,16)12(3)10-6-8-11(14)9-7-10/h6-9,14H,4-5H2,1-3H3
InChIKeyIDTPHEQQHQUBTF-UHFFFAOYSA-N
XLogP1.41
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(diethylsulfamoyl)-4-N-methylbenzene-1,4-diamine
CID 28894518
4-[diethylsulfamoyl(methyl)amino]benzenecarbothioamide
CID 62971569
N-(4-hydroxyphenyl)-N-methyl-2-methylsulfonylethanesulfonamide
CID 55175048
methyl 3-[[(4-hydroxyphenyl)-methylsulfamoyl]-methylamino]propanoate
CID 107734048
N-ethyl-4-hydroxy-N-propylbenzenesulfonamide
CID 43269048
1-ethyl-3-(4-hydroxyphenyl)-1,3-dimethylurea
CID 79159272
methyl 3-[(4-hydroxyphenyl)-methylsulfamoyl]propanoate
CID 54951513
4-(2-aminoethyl)-N-(4-hydroxyphenyl)-N-methylbenzenesulfonamide
CID 107734191
2-fluoro-N-(4-hydroxyphenyl)-N-methylbenzenesulfonamide
CID 2369671
1-[2-(diethylsulfamoylamino)ethyl]-4-hydroxybenzene
CID 54904084
2-tert-butyl-N-(diethylsulfamoyl)-1-ethyl-N-methylbenzimidazol-5-amine
CID 143022121
4-(dimethylamino)-N,N-diethylbenzenesulfonamide
CID 11043368

Frequently Asked Questions

What is the IUPAC name of 4-[diethylsulfamoyl(methyl)amino]phenol?
The IUPAC name of 4-[diethylsulfamoyl(methyl)amino]phenol (CID 28785528) is 4-[diethylsulfamoyl(methyl)amino]phenol.
What is the SMILES notation for 4-[diethylsulfamoyl(methyl)amino]phenol?
The canonical SMILES for 4-[diethylsulfamoyl(methyl)amino]phenol is CCN(CC)S(=O)(=O)N(C)c1ccc(O)cc1.
What is the InChIKey of 4-[diethylsulfamoyl(methyl)amino]phenol?
The InChIKey is IDTPHEQQHQUBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-4-13(5-2)17(15,16)12(3)10-6-8-11(14)9-7-10/h6-9,14H,4-5H2,1-3H3.
What are the key properties of 4-[diethylsulfamoyl(methyl)amino]phenol?
4-[diethylsulfamoyl(methyl)amino]phenol has a molecular weight of 258.34 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[diethylsulfamoyl(methyl)amino]phenol is sourced from PubChem (CID 28785528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).