3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline

C16H20N2Te2 — CID 139266297

IUPAC3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline
SMILESCc1cc([Te][Te]c2ccc(C)c(N)c2C)cc(C)c1N
InChIInChI=1S/C16H20N2Te2/c1-9-5-6-14(12(4)16(9)18)20-19-13-7-10(2)15(17)11(3)8-13/h5-8H,17-18H2,1-4H3
InChIKeyPJLUHGJKTPULAR-UHFFFAOYSA-N
MW495.55 g/mol
LogP1.36
Rot. Bonds3

About 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline

3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline (PubChem CID 139266297) has the molecular formula C16H20N2Te2 and a molecular weight of 495.55 g/mol. Its IUPAC name is 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline.

Molecular Properties

Compound Name3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline
PubChem CID139266297
Molecular FormulaC16H20N2Te2
Molecular Weight495.55 g/mol
Exact Mass499.98
IUPAC Name3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline
SMILESCc1cc([Te][Te]c2ccc(C)c(N)c2C)cc(C)c1N
InChIInChI=1S/C16H20N2Te2/c1-9-5-6-14(12(4)16(9)18)20-19-13-7-10(2)15(17)11(3)8-13/h5-8H,17-18H2,1-4H3
InChIKeyPJLUHGJKTPULAR-UHFFFAOYSA-N
XLogP1.36
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500495.55
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline?
The IUPAC name of 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline (CID 139266297) is 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline.
What is the SMILES notation for 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline?
The canonical SMILES for 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline is Cc1cc([Te][Te]c2ccc(C)c(N)c2C)cc(C)c1N.
What is the InChIKey of 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline?
The InChIKey is PJLUHGJKTPULAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2Te2/c1-9-5-6-14(12(4)16(9)18)20-19-13-7-10(2)15(17)11(3)8-13/h5-8H,17-18H2,1-4H3.
What are the key properties of 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline?
3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline has a molecular weight of 495.55 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-amino-3,5-dimethylphenyl)ditellanyl]-2,6-dimethylaniline is sourced from PubChem (CID 139266297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).