copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide

C15H16CuN2O5+2 — CID 3876946

IUPACcopper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide
SMILES[Cu+2].[H]/[O+]=C(/NN=Cc1cccc(OC)c1[OH2+])c1ccccc1[O-].[OH-]
InChIInChI=1S/C15H14N2O4.Cu.H2O/c1-21-13-8-4-5-10(14(13)19)9-16-17-15(20)11-6-2-3-7-12(11)18;;/h2-9,18-19H,1H3,(H,17,20);;1H2/q;+2;
InChIKeyGGLVYDZDUVWOKA-UHFFFAOYSA-N
MW367.85 g/mol
LogP0.50
Rot. Bonds4

About copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide

copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide (PubChem CID 3876946) has the molecular formula C15H16CuN2O5+2 and a molecular weight of 367.85 g/mol. Its IUPAC name is copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide.

Molecular Properties

Compound Namecopper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide
PubChem CID3876946
Molecular FormulaC15H16CuN2O5+2
Molecular Weight367.85 g/mol
Exact Mass367.03
IUPAC Namecopper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide
SMILES[Cu+2].[H]/[O+]=C(/NN=Cc1cccc(OC)c1[OH2+])c1ccccc1[O-].[OH-]
InChIInChI=1S/C15H14N2O4.Cu.H2O/c1-21-13-8-4-5-10(14(13)19)9-16-17-15(20)11-6-2-3-7-12(11)18;;/h2-9,18-19H,1H3,(H,17,20);;1H2/q;+2;
InChIKeyGGLVYDZDUVWOKA-UHFFFAOYSA-N
XLogP0.50
TPSA130.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.85
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-[(carbamoylhydrazinylidene)methyl]-6-methoxyphenyl]oxidanium;palladium(2+);hydroxide
CID 50911188
[2-[(carbamothioylhydrazinylidene)methyl]-6-methoxyphenyl]oxidanium;platinum(2+)
CID 50910386
copper;[2-[(carbamoylhydrazinylidene)methyl]-6-methoxyphenyl]oxidanium;pyridine
CID 50910692
manganese(2+);[2-methoxy-6-[(pyridine-4-carbonylhydrazinylidene)methyl]phenyl]oxidanium
CID 50910170
copper [amino(oxoniumylidene)methyl]-[(3-methoxy-2-oxoniophenyl)methylideneamino]azanide
CID 3837398
zinc [amino(oxoniumylidene)methyl]-[(3-methoxy-2-oxoniophenyl)methylideneamino]azanide
CID 3253666
N-[(2-hydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 3470891
[amino(oxoniumylidene)methyl]-[(3-methoxy-2-oxoniophenyl)methylideneamino]azanide;nickel(2+);1,10-phenanthroline;hydroxide
CID 3482345
N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 136766974
[2-[(2Z)-2-[(2,3-dimethoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-trimethylazanium
CID 5474234
2-hydroxy-N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-3-methoxybenzamide
CID 136706071
[2-[(2Z)-2-[(2-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-trimethylazanium chloride
CID 54609722

Frequently Asked Questions

What is the IUPAC name of copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide?
The IUPAC name of copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide (CID 3876946) is copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide.
What is the SMILES notation for copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide?
The canonical SMILES for copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide is [Cu+2].[H]/[O+]=C(/NN=Cc1cccc(OC)c1[OH2+])c1ccccc1[O-].[OH-].
What is the InChIKey of copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide?
The InChIKey is GGLVYDZDUVWOKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4.Cu.H2O/c1-21-13-8-4-5-10(14(13)19)9-16-17-15(20)11-6-2-3-7-12(11)18;;/h2-9,18-19H,1H3,(H,17,20);;1H2/q;+2;.
What are the key properties of copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide?
copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide has a molecular weight of 367.85 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2-[[2-[(3-methoxy-2-oxoniophenyl)methylidene]hydrazinyl]-oxoniumylidenemethyl]phenolate;hydroxide is sourced from PubChem (CID 3876946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).