N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide

C22H28N2O2Te2 — CID 19064296

IUPACN-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide
SMILESCC(=O)N(C)c1cc(C)c(C)cc1[Te][Te]c1cc(C)c(C)cc1N(C)C(C)=O
InChIInChI=1S/C22H28N2O2Te2/c1-13-9-19(23(7)17(5)25)21(11-15(13)3)27-28-22-12-16(4)14(2)10-20(22)24(8)18(6)26/h9-12H,1-8H3
InChIKeyJOVVXZKTIITYAA-UHFFFAOYSA-N
MW607.68 g/mol
LogP2.16
Rot. Bonds5

About N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide

N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide (PubChem CID 19064296) has the molecular formula C22H28N2O2Te2 and a molecular weight of 607.68 g/mol. Its IUPAC name is N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide
PubChem CID19064296
Molecular FormulaC22H28N2O2Te2
Molecular Weight607.68 g/mol
Exact Mass612.03
IUPAC NameN-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide
SMILESCC(=O)N(C)c1cc(C)c(C)cc1[Te][Te]c1cc(C)c(C)cc1N(C)C(C)=O
InChIInChI=1S/C22H28N2O2Te2/c1-13-9-19(23(7)17(5)25)21(11-15(13)3)27-28-22-12-16(4)14(2)10-20(22)24(8)18(6)26/h9-12H,1-8H3
InChIKeyJOVVXZKTIITYAA-UHFFFAOYSA-N
XLogP2.16
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500607.68
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxy-4,5-dimethylphenyl)-N-methylacetamide
CID 115190996
N-(4,5-dimethoxy-2-methylphenyl)-N-methylacetamide
CID 115191032
N-(2,4-ditert-butylphenyl)-N-methylacetamide
CID 517590
N-(4,5-dimethoxy-2-methylphenyl)-N-methylcarbamoyl bromide
CID 115193445
N-[2-[acetyl(methyl)amino]-5-fluorophenyl]-3,4-dimethylbenzamide
CID 113092818
1,3-dimethyl-1-(2,4,5-trimethylphenyl)urea
CID 115169018
N-methyl-N-(5-methyl-1,2-oxazol-4-yl)acetamide
CID 13483373
2-amino-N-methyl-N-(2,4,5-trimethylphenyl)acetamide
CID 82492268
2,2,2-trifluoro-N-methyl-N-(2,4,5-trimethylphenyl)acetamide
CID 115190193
N-(5-ethyl-2-fluorophenyl)-N-methylacetamide
CID 150244406
N-(4-fluoro-2-methoxyphenyl)-N-methylacetamide
CID 134094138
[3-[acetyl(methyl)amino]-4-hydroxyphenyl]arsonic acid
CID 174298092

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide?
The IUPAC name of N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide (CID 19064296) is N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide.
What is the SMILES notation for N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide?
The canonical SMILES for N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide is CC(=O)N(C)c1cc(C)c(C)cc1[Te][Te]c1cc(C)c(C)cc1N(C)C(C)=O.
What is the InChIKey of N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide?
The InChIKey is JOVVXZKTIITYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2Te2/c1-13-9-19(23(7)17(5)25)21(11-15(13)3)27-28-22-12-16(4)14(2)10-20(22)24(8)18(6)26/h9-12H,1-8H3.
What are the key properties of N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide?
N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide has a molecular weight of 607.68 g/mol, XLogP of 2.16, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-[acetyl(methyl)amino]-4,5-dimethylphenyl]ditellanyl]-4,5-dimethylphenyl]-N-methylacetamide is sourced from PubChem (CID 19064296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).