copper 2-(2,3-dimethylanilino)benzoate

C15H14CuNO2+ — CID 135564277

IUPACcopper 2-(2,3-dimethylanilino)benzoate
SMILESCc1cccc(Nc2ccccc2C(=O)[O-])c1C.[Cu+2]
InChIInChI=1S/C15H15NO2.Cu/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18;/h3-9,16H,1-2H3,(H,17,18);/q;+2/p-1
InChIKeyGUYDGUDDNNGCAD-UHFFFAOYSA-M
MW303.83 g/mol
LogP2.41
Rot. Bonds3

About copper 2-(2,3-dimethylanilino)benzoate

copper 2-(2,3-dimethylanilino)benzoate (PubChem CID 135564277) has the molecular formula C15H14CuNO2+ and a molecular weight of 303.83 g/mol. Its IUPAC name is copper 2-(2,3-dimethylanilino)benzoate.

Molecular Properties

Compound Namecopper 2-(2,3-dimethylanilino)benzoate
PubChem CID135564277
Molecular FormulaC15H14CuNO2+
Molecular Weight303.83 g/mol
Exact Mass303.03
IUPAC Namecopper 2-(2,3-dimethylanilino)benzoate
SMILESCc1cccc(Nc2ccccc2C(=O)[O-])c1C.[Cu+2]
InChIInChI=1S/C15H15NO2.Cu/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18;/h3-9,16H,1-2H3,(H,17,18);/q;+2/p-1
InChIKeyGUYDGUDDNNGCAD-UHFFFAOYSA-M
XLogP2.41
TPSA52.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.83
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

copper bis(2-(3-chloro-2-methylanilino)benzoate)
CID 132532819
sodium 2-(2,3-dimethylanilino)-3-methylbenzoate
CID 23680214
deuterio 2-(2,3-dimethylanilino)benzoate
CID 175757896
CID 10739949
CID 10739949
2-[(2,3-dimethylphenyl)carbamoyl]benzoate
CID 6950917
2-(2,3-dimethylanilino)-N-(2-fluorophenyl)benzamide
CID 18273886
2-[2-(2,3-dimethylphenyl)hydrazinyl]benzoic acid
CID 163528026
2-[2-(2,3-dimethylanilino)phenyl]acetic acid
CID 14762938
N-(4-acetylphenyl)-2-(2,3-dimethylanilino)benzamide
CID 18207871
2,3-dimethyl-N-phenylaniline
CID 14952469
bis(2-(2,3-dimethylanilino)benzoic acid);4-[(E)-2-pyridin-4-ylethenyl]pyridine
CID 139205083
2-(2,3-dimethylanilino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 27743019

Frequently Asked Questions

What is the IUPAC name of copper 2-(2,3-dimethylanilino)benzoate?
The IUPAC name of copper 2-(2,3-dimethylanilino)benzoate (CID 135564277) is copper 2-(2,3-dimethylanilino)benzoate.
What is the SMILES notation for copper 2-(2,3-dimethylanilino)benzoate?
The canonical SMILES for copper 2-(2,3-dimethylanilino)benzoate is Cc1cccc(Nc2ccccc2C(=O)[O-])c1C.[Cu+2].
What is the InChIKey of copper 2-(2,3-dimethylanilino)benzoate?
The InChIKey is GUYDGUDDNNGCAD-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H15NO2.Cu/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18;/h3-9,16H,1-2H3,(H,17,18);/q;+2/p-1.
What are the key properties of copper 2-(2,3-dimethylanilino)benzoate?
copper 2-(2,3-dimethylanilino)benzoate has a molecular weight of 303.83 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper 2-(2,3-dimethylanilino)benzoate is sourced from PubChem (CID 135564277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).