O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine

C12H12N2O2S — CID 172565165

IUPACO-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine
SMILESNOc1ccccc1Sc1ccccc1ON
InChIInChI=1S/C12H12N2O2S/c13-15-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-14/h1-8H,13-14H2
InChIKeyUCGWNBBFKZUFHJ-UHFFFAOYSA-N
MW248.31 g/mol
LogP2.34
Rot. Bonds4

About O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine

O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine (PubChem CID 172565165) has the molecular formula C12H12N2O2S and a molecular weight of 248.31 g/mol. Its IUPAC name is O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine.

Molecular Properties

Compound NameO-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine
PubChem CID172565165
Molecular FormulaC12H12N2O2S
Molecular Weight248.31 g/mol
Exact Mass248.06
IUPAC NameO-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine
SMILESNOc1ccccc1Sc1ccccc1ON
InChIInChI=1S/C12H12N2O2S/c13-15-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-14/h1-8H,13-14H2
InChIKeyUCGWNBBFKZUFHJ-UHFFFAOYSA-N
XLogP2.34
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.31
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-methoxyphenyl)sulfanylphenyl]ethanol
CID 63835196
1-(chloromethyl)-2-(2-methoxyphenyl)sulfanylbenzene
CID 141087077
1-methoxy-4-(2-methoxyphenyl)sulfanyl-2,5-dimethylbenzene
CID 18738928
2-(2-methoxyphenyl)sulfanylbenzaldehyde
CID 12946428
O-(2-ethoxyphenyl)hydroxylamine
CID 70279336
1-[2-(2-methoxyphenyl)sulfanylphenyl]butan-2-amine
CID 63818198
4-(2-ethoxyphenyl)sulfanylaniline
CID 70586247
[2-(2-fluorophenyl)sulfanylphenyl] acetate
CID 20513500
O-[2-(difluoromethylsulfonyl)phenyl]hydroxylamine
CID 79427810
4-(2-methoxyphenyl)sulfanyl-3-(trifluoromethyl)aniline
CID 61298177
4-(2-phenylsulfanylphenoxy)butan-1-amine;hydrochloride
CID 71388517
2-(2-pyrimidin-2-yloxyphenyl)sulfanylpyrimidine
CID 54179236

Frequently Asked Questions

What is the IUPAC name of O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine?
The IUPAC name of O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine (CID 172565165) is O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine.
What is the SMILES notation for O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine?
The canonical SMILES for O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine is NOc1ccccc1Sc1ccccc1ON.
What is the InChIKey of O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine?
The InChIKey is UCGWNBBFKZUFHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2S/c13-15-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-14/h1-8H,13-14H2.
What are the key properties of O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine?
O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine has a molecular weight of 248.31 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-(2-aminooxyphenyl)sulfanylphenyl]hydroxylamine is sourced from PubChem (CID 172565165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).