1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene

C11H18N2O4S — CID 107736611

IUPAC1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene
SMILESCCN(c1cccc(O)c1)S(=O)(=O)NCCOC
InChIInChI=1S/C11H18N2O4S/c1-3-13(10-5-4-6-11(14)9-10)18(15,16)12-7-8-17-2/h4-6,9,12,14H,3,7-8H2,1-2H3
InChIKeyPXBMGESJZWVJLK-UHFFFAOYSA-N
MW274.34 g/mol
LogP0.70
Rot. Bonds7

About 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene

1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene (PubChem CID 107736611) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene.

Molecular Properties

Compound Name1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene
PubChem CID107736611
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC Name1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene
SMILESCCN(c1cccc(O)c1)S(=O)(=O)NCCOC
InChIInChI=1S/C11H18N2O4S/c1-3-13(10-5-4-6-11(14)9-10)18(15,16)12-7-8-17-2/h4-6,9,12,14H,3,7-8H2,1-2H3
InChIKeyPXBMGESJZWVJLK-UHFFFAOYSA-N
XLogP0.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[(2-methoxyethylsulfamoylamino)methyl]phenol
CID 114815535
N-ethyl-N-(3-hydroxyphenyl)-2,2-dimethylpropane-1-sulfonamide
CID 107736583
4-[N-(2-methoxyethylsulfamoyl)anilino]butanoic acid
CID 114814446
N-ethyl-N-(3-hydroxyphenyl)-3-methylbutane-1-sulfonamide
CID 103223825
methyl N-ethyl-N-(3-hydroxyphenyl)carbamate
CID 107734186
N-ethyl-N-(3-hydroxyphenyl)azepane-1-sulfonamide
CID 103223804
3-[bis[2-(2-methoxyethoxy)ethyl]amino]phenol
CID 59211296
5-[ethyl-(3-hydroxyphenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 103223838
5-amino-2-chloro-N-ethyl-N-(3-hydroxyphenyl)benzenesulfonamide
CID 107733551
3-[ethyl-(3-methylphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 109063706
N-ethyl-2,5-difluoro-N-(3-hydroxyphenyl)benzenesulfonamide
CID 103223870
2-amino-N-ethyl-3-fluoro-N-(3-hydroxyphenyl)benzenesulfonamide
CID 107733558

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene?
The IUPAC name of 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene (CID 107736611) is 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene.
What is the SMILES notation for 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene?
The canonical SMILES for 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene is CCN(c1cccc(O)c1)S(=O)(=O)NCCOC.
What is the InChIKey of 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene?
The InChIKey is PXBMGESJZWVJLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-3-13(10-5-4-6-11(14)9-10)18(15,16)12-7-8-17-2/h4-6,9,12,14H,3,7-8H2,1-2H3.
What are the key properties of 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene?
1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene has a molecular weight of 274.34 g/mol, XLogP of 0.70, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(2-methoxyethylsulfamoyl)amino]-3-hydroxybenzene is sourced from PubChem (CID 107736611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).