4-[(4-aminooxyphenyl)methyl]phenol

C13H13NO2 — CID 122683282

IUPAC4-[(4-aminooxyphenyl)methyl]phenol
SMILESNOc1ccc(Cc2ccc(O)cc2)cc1
InChIInChI=1S/C13H13NO2/c14-16-13-7-3-11(4-8-13)9-10-1-5-12(15)6-2-10/h1-8,15H,9,14H2
InChIKeyDEFIUSSXQOVQCS-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.24
Rot. Bonds3

About 4-[(4-aminooxyphenyl)methyl]phenol

4-[(4-aminooxyphenyl)methyl]phenol (PubChem CID 122683282) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 4-[(4-aminooxyphenyl)methyl]phenol.

Molecular Properties

Compound Name4-[(4-aminooxyphenyl)methyl]phenol
PubChem CID122683282
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name4-[(4-aminooxyphenyl)methyl]phenol
SMILESNOc1ccc(Cc2ccc(O)cc2)cc1
InChIInChI=1S/C13H13NO2/c14-16-13-7-3-11(4-8-13)9-10-1-5-12(15)6-2-10/h1-8,15H,9,14H2
InChIKeyDEFIUSSXQOVQCS-UHFFFAOYSA-N
XLogP2.24
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-aminooxyphenol
CID 67279043
4-[(4-hydroxyphenyl)methyl]phenol
CID 12111
4-[[4-(sulfanylmethoxy)phenyl]methyl]phenol
CID 89039452
4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol
CID 58720488
[4-[(4-hydroxyphenyl)methyl]phenyl] carbamimidate
CID 44562281
4-[(4-prop-2-enoxyphenyl)methyl]phenol
CID 68636078
4-[[4-[[3-[[4-(aminomethyl)phenoxy]methyl]phenyl]methoxy]phenyl]methyl]phenol
CID 20685429
CID 131886054
CID 131886054
4-[[4-[2,2,4,4-tetrafluoro-5-[4-[(4-hydroxyphenyl)methyl]phenoxy]pentoxy]phenyl]methyl]phenol
CID 58288779
bis(benzene-1,4-diol);benzylbenzene
CID 159915102
(4-aminooxyphenyl)methyl nitrate
CID 144534541
4-[[3-[3-[(4-hydroxyphenyl)methyl]phenoxy]phenyl]methyl]phenol
CID 101277634

Frequently Asked Questions

What is the IUPAC name of 4-[(4-aminooxyphenyl)methyl]phenol?
The IUPAC name of 4-[(4-aminooxyphenyl)methyl]phenol (CID 122683282) is 4-[(4-aminooxyphenyl)methyl]phenol.
What is the SMILES notation for 4-[(4-aminooxyphenyl)methyl]phenol?
The canonical SMILES for 4-[(4-aminooxyphenyl)methyl]phenol is NOc1ccc(Cc2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(4-aminooxyphenyl)methyl]phenol?
The InChIKey is DEFIUSSXQOVQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c14-16-13-7-3-11(4-8-13)9-10-1-5-12(15)6-2-10/h1-8,15H,9,14H2.
What are the key properties of 4-[(4-aminooxyphenyl)methyl]phenol?
4-[(4-aminooxyphenyl)methyl]phenol has a molecular weight of 215.25 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-aminooxyphenyl)methyl]phenol is sourced from PubChem (CID 122683282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).