bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)

C16H16N2O2Y+ — CID 18740562

IUPACbis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)
SMILESCC(=[N-])c1ccccc1O.CC(=[N-])c1ccccc1O.[Y+3]
InChIInChI=1S/2C8H8NO.Y/c2*1-6(9)7-4-2-3-5-8(7)10;/h2*2-5,10H,1H3;/q2*-1;+3
InChIKeyIJXUMJQRUAQMJV-UHFFFAOYSA-N
MW357.22 g/mol
LogP3.54
Rot. Bonds2

About bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)

bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+) (PubChem CID 18740562) has the molecular formula C16H16N2O2Y+ and a molecular weight of 357.22 g/mol. Its IUPAC name is bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+).

Molecular Properties

Compound Namebis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)
PubChem CID18740562
Molecular FormulaC16H16N2O2Y+
Molecular Weight357.22 g/mol
Exact Mass357.03
IUPAC Namebis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)
SMILESCC(=[N-])c1ccccc1O.CC(=[N-])c1ccccc1O.[Y+3]
InChIInChI=1S/2C8H8NO.Y/c2*1-6(9)7-4-2-3-5-8(7)10;/h2*2-5,10H,1H3;/q2*-1;+3
InChIKeyIJXUMJQRUAQMJV-UHFFFAOYSA-N
XLogP3.54
TPSA85.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.22
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)?
The IUPAC name of bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+) (CID 18740562) is bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+).
What is the SMILES notation for bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)?
The canonical SMILES for bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+) is CC(=[N-])c1ccccc1O.CC(=[N-])c1ccccc1O.[Y+3].
What is the InChIKey of bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)?
The InChIKey is IJXUMJQRUAQMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H8NO.Y/c2*1-6(9)7-4-2-3-5-8(7)10;/h2*2-5,10H,1H3;/q2*-1;+3.
What are the key properties of bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+)?
bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+) has a molecular weight of 357.22 g/mol, XLogP of 3.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-(2-hydroxyphenyl)ethylideneazanide);yttrium(3+) is sourced from PubChem (CID 18740562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).