copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate

C20H22CuN2O2 — CID 23626390

IUPACcopper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate
SMILESCC(C)Cc1ccc(C(C)/C([O-])=N/N=C\c2ccccc2[O-])cc1.[Cu+2]
InChIInChI=1S/C20H24N2O2.Cu/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(24)22-21-13-18-6-4-5-7-19(18)23;/h4-11,13-15,23H,12H2,1-3H3,(H,22,24);/q;+2/p-2/b21-13-;
InChIKeyGWMOJLPZDIHNTF-GNWMQEPYSA-L
MW385.95 g/mol
LogP2.85
Rot. Bonds6

About copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate

copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate (PubChem CID 23626390) has the molecular formula C20H22CuN2O2 and a molecular weight of 385.95 g/mol. Its IUPAC name is copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate.

Molecular Properties

Compound Namecopper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate
PubChem CID23626390
Molecular FormulaC20H22CuN2O2
Molecular Weight385.95 g/mol
Exact Mass385.10
IUPAC Namecopper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate
SMILESCC(C)Cc1ccc(C(C)/C([O-])=N/N=C\c2ccccc2[O-])cc1.[Cu+2]
InChIInChI=1S/C20H24N2O2.Cu/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(24)22-21-13-18-6-4-5-7-19(18)23;/h4-11,13-15,23H,12H2,1-3H3,(H,22,24);/q;+2/p-2/b21-13-;
InChIKeyGWMOJLPZDIHNTF-GNWMQEPYSA-L
XLogP2.85
TPSA70.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.95
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate?
The IUPAC name of copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate (CID 23626390) is copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate.
What is the SMILES notation for copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate?
The canonical SMILES for copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate is CC(C)Cc1ccc(C(C)/C([O-])=N/N=C\c2ccccc2[O-])cc1.[Cu+2].
What is the InChIKey of copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate?
The InChIKey is GWMOJLPZDIHNTF-GNWMQEPYSA-L. The full InChI is InChI=1S/C20H24N2O2.Cu/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(24)22-21-13-18-6-4-5-7-19(18)23;/h4-11,13-15,23H,12H2,1-3H3,(H,22,24);/q;+2/p-2/b21-13-;.
What are the key properties of copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate?
copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate has a molecular weight of 385.95 g/mol, XLogP of 2.85, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper (NZ,1Z)-2-[4-(2-methylpropyl)phenyl]-N-[(2-oxidophenyl)methylidene]propanehydrazonate is sourced from PubChem (CID 23626390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).