copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide

C10H13CuN2 — CID 146169420

IUPACcopper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide
SMILESCN(C)CC(=[N-])c1ccccc1.[Cu+]
InChIInChI=1S/C10H13N2.Cu/c1-12(2)8-10(11)9-6-4-3-5-7-9;/h3-7H,8H2,1-2H3;/q-1;+1
InChIKeyOJZFVOQKFHSNCZ-UHFFFAOYSA-N
MW224.77 g/mol
LogP1.60
Rot. Bonds3

About copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide

copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide (PubChem CID 146169420) has the molecular formula C10H13CuN2 and a molecular weight of 224.77 g/mol. Its IUPAC name is copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide.

Molecular Properties

Compound Namecopper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide
PubChem CID146169420
Molecular FormulaC10H13CuN2
Molecular Weight224.77 g/mol
Exact Mass224.04
IUPAC Namecopper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide
SMILESCN(C)CC(=[N-])c1ccccc1.[Cu+]
InChIInChI=1S/C10H13N2.Cu/c1-12(2)8-10(11)9-6-4-3-5-7-9;/h3-7H,8H2,1-2H3;/q-1;+1
InChIKeyOJZFVOQKFHSNCZ-UHFFFAOYSA-N
XLogP1.60
TPSA25.54 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.77
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide?
The IUPAC name of copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide (CID 146169420) is copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide.
What is the SMILES notation for copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide?
The canonical SMILES for copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide is CN(C)CC(=[N-])c1ccccc1.[Cu+].
What is the InChIKey of copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide?
The InChIKey is OJZFVOQKFHSNCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N2.Cu/c1-12(2)8-10(11)9-6-4-3-5-7-9;/h3-7H,8H2,1-2H3;/q-1;+1.
What are the key properties of copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide?
copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide has a molecular weight of 224.77 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);[2-(dimethylamino)-1-phenylethylidene]azanide is sourced from PubChem (CID 146169420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).