copper(1+);bis(2,4-dimethylpyridine);perchlorate

C14H18ClCuN2O4 — CID 71364733

IUPACcopper(1+);bis(2,4-dimethylpyridine);perchlorate
SMILESCc1ccnc(C)c1.Cc1ccnc(C)c1.[Cu+].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2C7H9N.ClHO4.Cu/c2*1-6-3-4-8-7(2)5-6;2-1(3,4)5;/h2*3-5H,1-2H3;(H,2,3,4,5);/q;;;+1/p-1
InChIKeySBDVGJHBVYRZGL-UHFFFAOYSA-M
MW377.31 g/mol
LogP-1.36
Rot. Bonds

About copper(1+);bis(2,4-dimethylpyridine);perchlorate

copper(1+);bis(2,4-dimethylpyridine);perchlorate (PubChem CID 71364733) has the molecular formula C14H18ClCuN2O4 and a molecular weight of 377.31 g/mol. Its IUPAC name is copper(1+);bis(2,4-dimethylpyridine);perchlorate.

Molecular Properties

Compound Namecopper(1+);bis(2,4-dimethylpyridine);perchlorate
PubChem CID71364733
Molecular FormulaC14H18ClCuN2O4
Molecular Weight377.31 g/mol
Exact Mass376.03
IUPAC Namecopper(1+);bis(2,4-dimethylpyridine);perchlorate
SMILESCc1ccnc(C)c1.Cc1ccnc(C)c1.[Cu+].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2C7H9N.ClHO4.Cu/c2*1-6-3-4-8-7(2)5-6;2-1(3,4)5;/h2*3-5H,1-2H3;(H,2,3,4,5);/q;;;+1/p-1
InChIKeySBDVGJHBVYRZGL-UHFFFAOYSA-M
XLogP-1.36
TPSA118.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.31
LogP ≤ 5-1.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of copper(1+);bis(2,4-dimethylpyridine);perchlorate?
The IUPAC name of copper(1+);bis(2,4-dimethylpyridine);perchlorate (CID 71364733) is copper(1+);bis(2,4-dimethylpyridine);perchlorate.
What is the SMILES notation for copper(1+);bis(2,4-dimethylpyridine);perchlorate?
The canonical SMILES for copper(1+);bis(2,4-dimethylpyridine);perchlorate is Cc1ccnc(C)c1.Cc1ccnc(C)c1.[Cu+].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of copper(1+);bis(2,4-dimethylpyridine);perchlorate?
The InChIKey is SBDVGJHBVYRZGL-UHFFFAOYSA-M. The full InChI is InChI=1S/2C7H9N.ClHO4.Cu/c2*1-6-3-4-8-7(2)5-6;2-1(3,4)5;/h2*3-5H,1-2H3;(H,2,3,4,5);/q;;;+1/p-1.
What are the key properties of copper(1+);bis(2,4-dimethylpyridine);perchlorate?
copper(1+);bis(2,4-dimethylpyridine);perchlorate has a molecular weight of 377.31 g/mol, XLogP of -1.36, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);bis(2,4-dimethylpyridine);perchlorate is sourced from PubChem (CID 71364733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).