N,N-dimethylaniline;nickel

C8H11NNi — CID 158294400

IUPACN,N-dimethylaniline;nickel
SMILESCN(C)c1ccccc1.[Ni]
InChIInChI=1S/C8H11N.Ni/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;
InChIKeyGLSQVAATEGRARK-UHFFFAOYSA-N
MW179.88 g/mol
LogP1.75
Rot. Bonds1

About N,N-dimethylaniline;nickel

N,N-dimethylaniline;nickel (PubChem CID 158294400) has the molecular formula C8H11NNi and a molecular weight of 179.88 g/mol. Its IUPAC name is N,N-dimethylaniline;nickel.

Molecular Properties

Compound NameN,N-dimethylaniline;nickel
PubChem CID158294400
Molecular FormulaC8H11NNi
Molecular Weight179.88 g/mol
Exact Mass179.02
IUPAC NameN,N-dimethylaniline;nickel
SMILESCN(C)c1ccccc1.[Ni]
InChIInChI=1S/C8H11N.Ni/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;
InChIKeyGLSQVAATEGRARK-UHFFFAOYSA-N
XLogP1.75
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.88
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylaniline;nickel?
The IUPAC name of N,N-dimethylaniline;nickel (CID 158294400) is N,N-dimethylaniline;nickel.
What is the SMILES notation for N,N-dimethylaniline;nickel?
The canonical SMILES for N,N-dimethylaniline;nickel is CN(C)c1ccccc1.[Ni].
What is the InChIKey of N,N-dimethylaniline;nickel?
The InChIKey is GLSQVAATEGRARK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.Ni/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;.
What are the key properties of N,N-dimethylaniline;nickel?
N,N-dimethylaniline;nickel has a molecular weight of 179.88 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylaniline;nickel is sourced from PubChem (CID 158294400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).