3-(3-methanehydrazonoylphenyl)phenol

C13H12N2O — CID 168529657

IUPAC3-(3-methanehydrazonoylphenyl)phenol
SMILESNN=Cc1cccc(-c2cccc(O)c2)c1
InChIInChI=1S/C13H12N2O/c14-15-9-10-3-1-4-11(7-10)12-5-2-6-13(16)8-12/h1-9,16H,14H2
InChIKeyGGWIHMUAPMLTQA-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.35
Rot. Bonds2

About 3-(3-methanehydrazonoylphenyl)phenol

3-(3-methanehydrazonoylphenyl)phenol (PubChem CID 168529657) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 3-(3-methanehydrazonoylphenyl)phenol.

Molecular Properties

Compound Name3-(3-methanehydrazonoylphenyl)phenol
PubChem CID168529657
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name3-(3-methanehydrazonoylphenyl)phenol
SMILESNN=Cc1cccc(-c2cccc(O)c2)c1
InChIInChI=1S/C13H12N2O/c14-15-9-10-3-1-4-11(7-10)12-5-2-6-13(16)8-12/h1-9,16H,14H2
InChIKeyGGWIHMUAPMLTQA-UHFFFAOYSA-N
XLogP2.35
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methanehydrazonoylphenyl)phenol?
The IUPAC name of 3-(3-methanehydrazonoylphenyl)phenol (CID 168529657) is 3-(3-methanehydrazonoylphenyl)phenol.
What is the SMILES notation for 3-(3-methanehydrazonoylphenyl)phenol?
The canonical SMILES for 3-(3-methanehydrazonoylphenyl)phenol is NN=Cc1cccc(-c2cccc(O)c2)c1.
What is the InChIKey of 3-(3-methanehydrazonoylphenyl)phenol?
The InChIKey is GGWIHMUAPMLTQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c14-15-9-10-3-1-4-11(7-10)12-5-2-6-13(16)8-12/h1-9,16H,14H2.
What are the key properties of 3-(3-methanehydrazonoylphenyl)phenol?
3-(3-methanehydrazonoylphenyl)phenol has a molecular weight of 212.25 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methanehydrazonoylphenyl)phenol is sourced from PubChem (CID 168529657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).