2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide

C10H16N4O4S — CID 114812273

IUPAC2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide
SMILESCCNS(=O)(=O)Nc1ccc(OC/C(N)=N/O)cc1
InChIInChI=1S/C10H16N4O4S/c1-2-12-19(16,17)14-8-3-5-9(6-4-8)18-7-10(11)13-15/h3-6,12,14-15H,2,7H2,1H3,(H2,11,13)
InChIKeyCHXKENIYDHVMCA-UHFFFAOYSA-N
MW288.33 g/mol
LogP0.08
Rot. Bonds7

About 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide

2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide (PubChem CID 114812273) has the molecular formula C10H16N4O4S and a molecular weight of 288.33 g/mol. Its IUPAC name is 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide
PubChem CID114812273
Molecular FormulaC10H16N4O4S
Molecular Weight288.33 g/mol
Exact Mass288.09
IUPAC Name2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide
SMILESCCNS(=O)(=O)Nc1ccc(OC/C(N)=N/O)cc1
InChIInChI=1S/C10H16N4O4S/c1-2-12-19(16,17)14-8-3-5-9(6-4-8)18-7-10(11)13-15/h3-6,12,14-15H,2,7H2,1H3,(H2,11,13)
InChIKeyCHXKENIYDHVMCA-UHFFFAOYSA-N
XLogP0.08
TPSA126.04 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 50.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-hydroxy-2-[3-(2-methylpropylsulfamoylamino)phenoxy]ethanimidamide
CID 114816568
2-(4-ethoxyphenoxy)-N'-hydroxyethanimidamide
CID 24695727
N-[4-(2-amino-2-hydroxyiminoethoxy)phenyl]-2-methoxyacetamide
CID 61277783
4-(ethylsulfamoylamino)phenol
CID 114809076
N-[4-[(2Z)-2-amino-2-hydroxyiminoethoxy]phenyl]-5-methylfuran-3-carboxamide
CID 114822665
2-(ethylsulfamoylamino)-N'-hydroxyethanimidamide
CID 104978310
2-[4-[(2,3,4,5,6-pentamethylphenyl)sulfonylamino]phenoxy]acetamide
CID 35545211
2-[3-(2-ethoxyethylsulfonylamino)phenoxy]-N'-hydroxyethanimidamide
CID 76988854
N'-hydroxy-2-(4-nitrophenoxy)ethanimidamide
CID 17052821
2-[4-(tert-butylsulfamoylamino)phenoxy]acetic acid
CID 114806168
2-[4-(2-ethoxyethylsulfonylamino)phenoxy]ethanethioamide
CID 63245611
[[2-[4-(methanesulfonamido)phenoxy]acetyl]amino]thiourea
CID 89489484

Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide (CID 114812273) is 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide is CCNS(=O)(=O)Nc1ccc(OC/C(N)=N/O)cc1.
What is the InChIKey of 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide?
The InChIKey is CHXKENIYDHVMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O4S/c1-2-12-19(16,17)14-8-3-5-9(6-4-8)18-7-10(11)13-15/h3-6,12,14-15H,2,7H2,1H3,(H2,11,13).
What are the key properties of 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide?
2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide has a molecular weight of 288.33 g/mol, XLogP of 0.08, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylsulfamoylamino)phenoxy]-N'-hydroxyethanimidamide is sourced from PubChem (CID 114812273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).