bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)

C18H20CuN3O2 — CID 135987878

IUPACbis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)
SMILESOc1ccccc1/C=N/CC[N-]CC/N=C/c1ccccc1O.[Cu+]
InChIInChI=1S/C18H20N3O2.Cu/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,22-23H,9-12H2;/q-1;+1/b20-13+,21-14+;
InChIKeyJPBPWBHZZPLFLS-MVYGGZIESA-N
MW373.92 g/mol
LogP3.01
Rot. Bonds8

About bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)

bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+) (PubChem CID 135987878) has the molecular formula C18H20CuN3O2 and a molecular weight of 373.92 g/mol. Its IUPAC name is bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+).

Molecular Properties

Compound Namebis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)
PubChem CID135987878
Molecular FormulaC18H20CuN3O2
Molecular Weight373.92 g/mol
Exact Mass373.09
IUPAC Namebis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)
SMILESOc1ccccc1/C=N/CC[N-]CC/N=C/c1ccccc1O.[Cu+]
InChIInChI=1S/C18H20N3O2.Cu/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,22-23H,9-12H2;/q-1;+1/b20-13+,21-14+;
InChIKeyJPBPWBHZZPLFLS-MVYGGZIESA-N
XLogP3.01
TPSA79.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.92
LogP ≤ 53.01
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;yttrium
CID 136641033
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
dichlorotitanium;2-[3-[(2-hydroxyphenyl)methylideneamino]propyliminomethyl]phenol
CID 135852922
2-[3-[(2-hydroxyphenyl)methylideneamino]propyliminomethyl]phenol;oxochromium;perchlorate
CID 135501072
2-[2-[(2-hydroxyphenyl)methylideneamino]ethyliminomethyl]phenol;oxochromium;perchlorate
CID 135406501
oxovanadium;bis(2-(propyliminomethyl)phenol)
CID 5242411
2-[2-(2-hydroxyethylamino)ethyliminomethyl]phenol
CID 139082337

Frequently Asked Questions

What is the IUPAC name of bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)?
The IUPAC name of bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+) (CID 135987878) is bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+).
What is the SMILES notation for bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)?
The canonical SMILES for bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+) is Oc1ccccc1/C=N/CC[N-]CC/N=C/c1ccccc1O.[Cu+].
What is the InChIKey of bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)?
The InChIKey is JPBPWBHZZPLFLS-MVYGGZIESA-N. The full InChI is InChI=1S/C18H20N3O2.Cu/c22-17-7-3-1-5-15(17)13-20-11-9-19-10-12-21-14-16-6-2-4-8-18(16)23;/h1-8,13-14,22-23H,9-12H2;/q-1;+1/b20-13+,21-14+;.
What are the key properties of bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+)?
bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+) has a molecular weight of 373.92 g/mol, XLogP of 3.01, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-[(2-hydroxyphenyl)methylideneamino]ethyl]azanide;copper(1+) is sourced from PubChem (CID 135987878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).