4-(ethylsulfamoylamino)phenol

C8H12N2O3S — CID 114809076

IUPAC4-(ethylsulfamoylamino)phenol
SMILESCCNS(=O)(=O)Nc1ccc(O)cc1
InChIInChI=1S/C8H12N2O3S/c1-2-9-14(12,13)10-7-3-5-8(11)6-4-7/h3-6,9-11H,2H2,1H3
InChIKeyCJBMAUJFBFTRRY-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.66
Rot. Bonds4

About 4-(ethylsulfamoylamino)phenol

4-(ethylsulfamoylamino)phenol (PubChem CID 114809076) has the molecular formula C8H12N2O3S and a molecular weight of 216.26 g/mol. Its IUPAC name is 4-(ethylsulfamoylamino)phenol.

Molecular Properties

Compound Name4-(ethylsulfamoylamino)phenol
PubChem CID114809076
Molecular FormulaC8H12N2O3S
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC Name4-(ethylsulfamoylamino)phenol
SMILESCCNS(=O)(=O)Nc1ccc(O)cc1
InChIInChI=1S/C8H12N2O3S/c1-2-9-14(12,13)10-7-3-5-8(11)6-4-7/h3-6,9-11H,2H2,1H3
InChIKeyCJBMAUJFBFTRRY-UHFFFAOYSA-N
XLogP0.66
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

4-Aminophenol
CID 403
n-Methyl-p-aminophenol
CID 5931
Metol
CID 5930
4-Aminophenol hydrochloride
CID 5828
4-Amino-4'-hydroxyazobenzene
CID 7640
N-(4-Hydroxyphenyl)benzenesulfonamide
CID 79622
p-Aminophenol sulfate
CID 45158326
4-Amino-2-iodophenol
CID 13774763
4-Azidophenol
CID 11622340
p-(Methylamino)phenol sulphate
CID 74737
4,4'-Dihydroxyazobenzene
CID 101245
N-(4-hydroxyphenyl)methanesulfonamide
CID 4483147

Frequently Asked Questions

What is the IUPAC name of 4-(ethylsulfamoylamino)phenol?
The IUPAC name of 4-(ethylsulfamoylamino)phenol (CID 114809076) is 4-(ethylsulfamoylamino)phenol.
What is the SMILES notation for 4-(ethylsulfamoylamino)phenol?
The canonical SMILES for 4-(ethylsulfamoylamino)phenol is CCNS(=O)(=O)Nc1ccc(O)cc1.
What is the InChIKey of 4-(ethylsulfamoylamino)phenol?
The InChIKey is CJBMAUJFBFTRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S/c1-2-9-14(12,13)10-7-3-5-8(11)6-4-7/h3-6,9-11H,2H2,1H3.
What are the key properties of 4-(ethylsulfamoylamino)phenol?
4-(ethylsulfamoylamino)phenol has a molecular weight of 216.26 g/mol, XLogP of 0.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfamoylamino)phenol is sourced from PubChem (CID 114809076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).