2-acetamido-4-methyltellanylbutanoic acid

C7H13NO3Te — CID 11108931

IUPAC2-acetamido-4-methyltellanylbutanoic acid
SMILESC[Te]CCC(NC(C)=O)C(=O)O
InChIInChI=1S/C7H13NO3Te/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)
InChIKeyOHQRDDFSKPXADR-UHFFFAOYSA-N
MW286.79 g/mol
LogP0.14
Rot. Bonds5

About 2-acetamido-4-methyltellanylbutanoic acid

2-acetamido-4-methyltellanylbutanoic acid (PubChem CID 11108931) has the molecular formula C7H13NO3Te and a molecular weight of 286.79 g/mol. Its IUPAC name is 2-acetamido-4-methyltellanylbutanoic acid.

Molecular Properties

Compound Name2-acetamido-4-methyltellanylbutanoic acid
PubChem CID11108931
Molecular FormulaC7H13NO3Te
Molecular Weight286.79 g/mol
Exact Mass289.00
IUPAC Name2-acetamido-4-methyltellanylbutanoic acid
SMILESC[Te]CCC(NC(C)=O)C(=O)O
InChIInChI=1S/C7H13NO3Te/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)
InChIKeyOHQRDDFSKPXADR-UHFFFAOYSA-N
XLogP0.14
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.79
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-acetamidopentanedioic acid
CID 161394708
(2R)-2-acetamido-4-methylsulfanylbutanoic acid
CID 6991987
sodium;(2S)-2-acetamidopentanedioic acid;hydride
CID 174759802
(2S)-2-acetamido-3-hydroxysulfanylpropanoic acid
CID 177062913
CID 170843089
CID 170843089
2,5-diacetamidopentanoic acid
CID 10398396
(2S)-2-acetamido-4-sulfobutanoic acid
CID 154303467
2-acetamidotetracosanoic acid
CID 13224380
tris(2-acetamidobutanedioic acid);phosphane
CID 174666186
(2S)-2-acetamido-3-sulfanylpropanoic acid;bis((2R)-2-acetamido-3-sulfanylpropanoic acid)
CID 87596071
2-acetamido-3-hydroxypropanoic acid;sulfane
CID 175323357
2-[[4-[[4-[(4-acetamido-4-carboxybutanoyl)amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]pentanedioic acid
CID 87414279

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-4-methyltellanylbutanoic acid?
The IUPAC name of 2-acetamido-4-methyltellanylbutanoic acid (CID 11108931) is 2-acetamido-4-methyltellanylbutanoic acid.
What is the SMILES notation for 2-acetamido-4-methyltellanylbutanoic acid?
The canonical SMILES for 2-acetamido-4-methyltellanylbutanoic acid is C[Te]CCC(NC(C)=O)C(=O)O.
What is the InChIKey of 2-acetamido-4-methyltellanylbutanoic acid?
The InChIKey is OHQRDDFSKPXADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3Te/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11).
What are the key properties of 2-acetamido-4-methyltellanylbutanoic acid?
2-acetamido-4-methyltellanylbutanoic acid has a molecular weight of 286.79 g/mol, XLogP of 0.14, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-4-methyltellanylbutanoic acid is sourced from PubChem (CID 11108931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).