2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol

C16H16N2O2 — CID 26518

IUPAC2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O
InChIInChI=1S/C16H16N2O2/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20/h1-8,11-12,19-20H,9-10H2/b17-11+,18-12+
InChIKeyVEUMANXWQDHAJV-JYFOCSDGSA-N
MW268.32 g/mol
LogP2.64
Rot. Bonds5

About 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol

2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol (PubChem CID 26518) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol.

Molecular Properties

Compound Name2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
PubChem CID26518
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O
InChIInChI=1S/C16H16N2O2/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20/h1-8,11-12,19-20H,9-10H2/b17-11+,18-12+
InChIKeyVEUMANXWQDHAJV-JYFOCSDGSA-N
XLogP2.64
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The IUPAC name of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol (CID 26518) is 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol.
What is the SMILES notation for 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The canonical SMILES for 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol is Oc1ccccc1/C=N/CC/N=C/c1ccccc1O.
What is the InChIKey of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
The InChIKey is VEUMANXWQDHAJV-JYFOCSDGSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20/h1-8,11-12,19-20H,9-10H2/b17-11+,18-12+.
What are the key properties of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol?
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol has a molecular weight of 268.32 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol is sourced from PubChem (CID 26518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).