copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol

C17H18CuN2O2 — CID 134991298

IUPACcopper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol
SMILESC/C(C/C(C)=N/c1ccccc1O)=N\c1ccccc1O.[Cu]
InChIInChI=1S/C17H18N2O2.Cu/c1-12(18-14-7-3-5-9-16(14)20)11-13(2)19-15-8-4-6-10-17(15)21;/h3-10,20-21H,11H2,1-2H3;/b18-12+,19-13+;
InChIKeyMYUBBLXPPTVQKF-VIWUVAGBSA-N
MW345.89 g/mol
LogP4.37
Rot. Bonds4

About copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol

copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol (PubChem CID 134991298) has the molecular formula C17H18CuN2O2 and a molecular weight of 345.89 g/mol. Its IUPAC name is copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol.

Molecular Properties

Compound Namecopper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol
PubChem CID134991298
Molecular FormulaC17H18CuN2O2
Molecular Weight345.89 g/mol
Exact Mass345.07
IUPAC Namecopper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol
SMILESC/C(C/C(C)=N/c1ccccc1O)=N\c1ccccc1O.[Cu]
InChIInChI=1S/C17H18N2O2.Cu/c1-12(18-14-7-3-5-9-16(14)20)11-13(2)19-15-8-4-6-10-17(15)21;/h3-10,20-21H,11H2,1-2H3;/b18-12+,19-13+;
InChIKeyMYUBBLXPPTVQKF-VIWUVAGBSA-N
XLogP4.37
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.89
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol?
The IUPAC name of copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol (CID 134991298) is copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol.
What is the SMILES notation for copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol?
The canonical SMILES for copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol is C/C(C/C(C)=N/c1ccccc1O)=N\c1ccccc1O.[Cu].
What is the InChIKey of copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol?
The InChIKey is MYUBBLXPPTVQKF-VIWUVAGBSA-N. The full InChI is InChI=1S/C17H18N2O2.Cu/c1-12(18-14-7-3-5-9-16(14)20)11-13(2)19-15-8-4-6-10-17(15)21;/h3-10,20-21H,11H2,1-2H3;/b18-12+,19-13+;.
What are the key properties of copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol?
copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol has a molecular weight of 345.89 g/mol, XLogP of 4.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2-[4-(2-hydroxyphenyl)iminopentan-2-ylideneamino]phenol is sourced from PubChem (CID 134991298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).