2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline

C14H16N2Te2 — CID 139266291

IUPAC2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline
SMILESCc1cc([Te][Te]c2cccc(C)c2N)ccc1N
InChIInChI=1S/C14H16N2Te2/c1-9-4-3-5-13(14(9)16)18-17-11-6-7-12(15)10(2)8-11/h3-8H,15-16H2,1-2H3
InChIKeyKJYPERIIAHGMPP-UHFFFAOYSA-N
MW467.50 g/mol
LogP0.74
Rot. Bonds3

About 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline

2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline (PubChem CID 139266291) has the molecular formula C14H16N2Te2 and a molecular weight of 467.50 g/mol. Its IUPAC name is 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline.

Molecular Properties

Compound Name2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline
PubChem CID139266291
Molecular FormulaC14H16N2Te2
Molecular Weight467.50 g/mol
Exact Mass471.94
IUPAC Name2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline
SMILESCc1cc([Te][Te]c2cccc(C)c2N)ccc1N
InChIInChI=1S/C14H16N2Te2/c1-9-4-3-5-13(14(9)16)18-17-11-6-7-12(15)10(2)8-11/h3-8H,15-16H2,1-2H3
InChIKeyKJYPERIIAHGMPP-UHFFFAOYSA-N
XLogP0.74
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.50
LogP ≤ 50.74
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 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline?
The IUPAC name of 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline (CID 139266291) is 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline.
What is the SMILES notation for 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline?
The canonical SMILES for 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline is Cc1cc([Te][Te]c2cccc(C)c2N)ccc1N.
What is the InChIKey of 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline?
The InChIKey is KJYPERIIAHGMPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2Te2/c1-9-4-3-5-13(14(9)16)18-17-11-6-7-12(15)10(2)8-11/h3-8H,15-16H2,1-2H3.
What are the key properties of 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline?
2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline has a molecular weight of 467.50 g/mol, XLogP of 0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-3-methylphenyl)ditellanyl]-6-methylaniline is sourced from PubChem (CID 139266291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).