N,N-dimethylaniline;mercury

C8H11HgN — CID 158660084

IUPACN,N-dimethylaniline;mercury
SMILESCN(C)c1ccccc1.[Hg]
InChIInChI=1S/C8H11N.Hg/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;
InChIKeyICQKSPFSNQIENS-UHFFFAOYSA-N
MW321.77 g/mol
LogP1.75
Rot. Bonds1

About N,N-dimethylaniline;mercury

N,N-dimethylaniline;mercury (PubChem CID 158660084) has the molecular formula C8H11HgN and a molecular weight of 321.77 g/mol. Its IUPAC name is N,N-dimethylaniline;mercury.

Molecular Properties

Compound NameN,N-dimethylaniline;mercury
PubChem CID158660084
Molecular FormulaC8H11HgN
Molecular Weight321.77 g/mol
Exact Mass323.06
IUPAC NameN,N-dimethylaniline;mercury
SMILESCN(C)c1ccccc1.[Hg]
InChIInChI=1S/C8H11N.Hg/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;
InChIKeyICQKSPFSNQIENS-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 ≤ 500321.77
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylaniline;mercury?
The IUPAC name of N,N-dimethylaniline;mercury (CID 158660084) is N,N-dimethylaniline;mercury.
What is the SMILES notation for N,N-dimethylaniline;mercury?
The canonical SMILES for N,N-dimethylaniline;mercury is CN(C)c1ccccc1.[Hg].
What is the InChIKey of N,N-dimethylaniline;mercury?
The InChIKey is ICQKSPFSNQIENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.Hg/c1-9(2)8-6-4-3-5-7-8;/h3-7H,1-2H3;.
What are the key properties of N,N-dimethylaniline;mercury?
N,N-dimethylaniline;mercury has a molecular weight of 321.77 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;mercury is sourced from PubChem (CID 158660084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).