copper;4H-imidazole

C3H4CuN2 — CID 66602426

IUPACcopper;4H-imidazole
SMILESC1=NC=NC1.[Cu]
InChIInChI=1S/C3H4N2.Cu/c1-2-5-3-4-1;/h1,3H,2H2;
InChIKeyRAJSMCWVZFDNBU-UHFFFAOYSA-N
MW131.62 g/mol
LogP0.10
Rot. Bonds

About copper;4H-imidazole

copper;4H-imidazole (PubChem CID 66602426) has the molecular formula C3H4CuN2 and a molecular weight of 131.62 g/mol. Its IUPAC name is copper;4H-imidazole.

Molecular Properties

Compound Namecopper;4H-imidazole
PubChem CID66602426
Molecular FormulaC3H4CuN2
Molecular Weight131.62 g/mol
Exact Mass130.97
IUPAC Namecopper;4H-imidazole
SMILESC1=NC=NC1.[Cu]
InChIInChI=1S/C3H4N2.Cu/c1-2-5-3-4-1;/h1,3H,2H2;
InChIKeyRAJSMCWVZFDNBU-UHFFFAOYSA-N
XLogP0.10
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.62
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze copper;4H-imidazole with MolForge

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

Launch Full Analysis

Related Compounds

4H-Imidazole
CID 12744656
2H-imidazole
CID 5288099
4h-Imidazole hydrochloride
CID 129789055
Imidazol-5-ylidene copper
CID 129892100
N-methylimidazolimine
CID 153819490
4H-imidazol-2-amine
CID 12744657
copper;4H-imidazole;dichloride
CID 20292010
sodium;4H-imidazole;chloride
CID 20553853
Imidazol-1-ium
CID 20778763
sodium;azanide;4H-imidazole
CID 23720674
4H-imidazole;osmium
CID 24782133
N-(4H-imidazol-2-yl)methanimine
CID 57894759

Frequently Asked Questions

What is the IUPAC name of copper;4H-imidazole?
The IUPAC name of copper;4H-imidazole (CID 66602426) is copper;4H-imidazole.
What is the SMILES notation for copper;4H-imidazole?
The canonical SMILES for copper;4H-imidazole is C1=NC=NC1.[Cu].
What is the InChIKey of copper;4H-imidazole?
The InChIKey is RAJSMCWVZFDNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.Cu/c1-2-5-3-4-1;/h1,3H,2H2;.
What are the key properties of copper;4H-imidazole?
copper;4H-imidazole has a molecular weight of 131.62 g/mol, XLogP of 0.10, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;4H-imidazole is sourced from PubChem (CID 66602426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).