N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine

C13H12NO3- — CID 143810064

IUPACN-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine
SMILESCOc1ccccc1-c1cccc(N([O-])O)c1
InChIInChI=1S/C13H12NO3/c1-17-13-8-3-2-7-12(13)10-5-4-6-11(9-10)14(15)16/h2-9,15H,1H3/q-1
InChIKeyYDUBRAFUPQBQCO-UHFFFAOYSA-N
MW230.24 g/mol
LogP3.06
Rot. Bonds3

About N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine

N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine (PubChem CID 143810064) has the molecular formula C13H12NO3- and a molecular weight of 230.24 g/mol. Its IUPAC name is N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine.

Molecular Properties

Compound NameN-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine
PubChem CID143810064
Molecular FormulaC13H12NO3-
Molecular Weight230.24 g/mol
Exact Mass230.08
IUPAC NameN-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine
SMILESCOc1ccccc1-c1cccc(N([O-])O)c1
InChIInChI=1S/C13H12NO3/c1-17-13-8-3-2-7-12(13)10-5-4-6-11(9-10)14(15)16/h2-9,15H,1H3/q-1
InChIKeyYDUBRAFUPQBQCO-UHFFFAOYSA-N
XLogP3.06
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methoxyphenyl)benzoic acid
CID 2759547
1-[[3-[3-[hydroxy(oxido)amino]phenyl]-4-methoxyphenyl]methyl]pyrrolidin-2-one
CID 88611873
1-fluoro-3-[3-(2-methoxyphenyl)phenyl]benzene
CID 175734991
2-methoxy-1-[3-methoxy-4-(3-methoxyphenyl)phenyl]-4-(2-methoxyphenyl)benzene
CID 174295636
4-(2-methoxyphenyl)-2-phenylthiophene
CID 102031786
1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one
CID 82120149
1-methoxy-2-[4-[4-(2-methoxyphenyl)phenyl]phenyl]benzene
CID 86116478
N-[[3-(2-methoxyphenyl)phenyl]methyl]ethanamine
CID 54911742
3-(2-methoxyphenyl)pyridine
CID 4133297
2-fluoro-4-(2-methoxyphenyl)phenol
CID 53219298
2-methoxy-6-(2-methoxyphenyl)benzoic acid
CID 22380946
methyl (E)-3-[3-(2-methoxyphenyl)phenyl]but-2-enoate
CID 82543553

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine?
The IUPAC name of N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine (CID 143810064) is N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine.
What is the SMILES notation for N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine?
The canonical SMILES for N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine is COc1ccccc1-c1cccc(N([O-])O)c1.
What is the InChIKey of N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine?
The InChIKey is YDUBRAFUPQBQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12NO3/c1-17-13-8-3-2-7-12(13)10-5-4-6-11(9-10)14(15)16/h2-9,15H,1H3/q-1.
What are the key properties of N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine?
N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine has a molecular weight of 230.24 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyphenyl)phenyl]-N-oxidohydroxylamine is sourced from PubChem (CID 143810064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).