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

C16H16N2O2Y — CID 136641033

IUPAC2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Y]
InChIInChI=1S/C16H16N2O2.Y/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+;
InChIKeyVRARWIJYFSPSAP-OYJDLGDISA-N
MW357.22 g/mol
LogP2.63
Rot. Bonds5

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

2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium (PubChem CID 136641033) has the molecular formula C16H16N2O2Y and a molecular weight of 357.22 g/mol. Its IUPAC name is 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium.

Molecular Properties

Compound Name2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium
PubChem CID136641033
Molecular FormulaC16H16N2O2Y
Molecular Weight357.22 g/mol
Exact Mass357.03
IUPAC Name2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Y]
InChIInChI=1S/C16H16N2O2.Y/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+;
InChIKeyVRARWIJYFSPSAP-OYJDLGDISA-N
XLogP2.63
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.22
LogP ≤ 52.63
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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Related Compounds

2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;manganese(2+)
CID 135568472
gold;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
CID 136506148
cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;hydrate
CID 135442959
sodium;cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol
CID 135544422
bis(2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol);iron;methanol
CID 135440481
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;oxovanadium(2+)
CID 158910145
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;oxochromium;perchlorate
CID 135406501
2-[2-(pyridin-2-ylmethylideneamino)ethyliminomethyl]phenol
CID 136763146
bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)
CID 135987878
dichlorotitanium;2-[3-[(2-hydroxyphenyl)methylideneamino]propyliminomethyl]phenol
CID 135852922
oxovanadium;bis(2-(propyliminomethyl)phenol)
CID 5242411
2-[2-(2-hydroxyethylamino)ethyliminomethyl]phenol
CID 139082337

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium?
The IUPAC name of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium (CID 136641033) is 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium.
What is the SMILES notation for 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium?
The canonical SMILES for 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium is Oc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Y].
What is the InChIKey of 2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium?
The InChIKey is VRARWIJYFSPSAP-OYJDLGDISA-N. The full InChI is InChI=1S/C16H16N2O2.Y/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;yttrium?
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;yttrium has a molecular weight of 357.22 g/mol, XLogP of 2.63, 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;yttrium is sourced from PubChem (CID 136641033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).