cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine

C21H21CoN3O2 — CID 137224656

IUPACcobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].c1ccncc1
InChIInChI=1S/C16H16N2O2.C5H5N.Co/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;1-2-4-6-5-3-1;/h1-8,11-12,19-20H,9-10H2;1-5H;/b17-11+,18-12+;;
InChIKeyIRMWIEHZBGBKOJ-SNTCFBDDSA-N
MW406.35 g/mol
LogP3.71
Rot. Bonds5

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

cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine (PubChem CID 137224656) has the molecular formula C21H21CoN3O2 and a molecular weight of 406.35 g/mol. Its IUPAC name is cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine.

Molecular Properties

Compound Namecobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine
PubChem CID137224656
Molecular FormulaC21H21CoN3O2
Molecular Weight406.35 g/mol
Exact Mass406.10
IUPAC Namecobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine
SMILESOc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].c1ccncc1
InChIInChI=1S/C16H16N2O2.C5H5N.Co/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;1-2-4-6-5-3-1;/h1-8,11-12,19-20H,9-10H2;1-5H;/b17-11+,18-12+;;
InChIKeyIRMWIEHZBGBKOJ-SNTCFBDDSA-N
XLogP3.71
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.35
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine?
The IUPAC name of cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine (CID 137224656) is cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine.
What is the SMILES notation for cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine?
The canonical SMILES for cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine is Oc1ccccc1/C=N/CC/N=C/c1ccccc1O.[Co].c1ccncc1.
What is the InChIKey of cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine?
The InChIKey is IRMWIEHZBGBKOJ-SNTCFBDDSA-N. The full InChI is InChI=1S/C16H16N2O2.C5H5N.Co/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;1-2-4-6-5-3-1;/h1-8,11-12,19-20H,9-10H2;1-5H;/b17-11+,18-12+;;.
What are the key properties of cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine?
cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine has a molecular weight of 406.35 g/mol, XLogP of 3.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;pyridine is sourced from PubChem (CID 137224656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).