3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol

C11H15NO2Te — CID 155523631

IUPAC3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol
SMILESC/C(=N\O)c1ccc([Te]CCCO)cc1
InChIInChI=1S/C11H15NO2Te/c1-9(12-14)10-3-5-11(6-4-10)15-8-2-7-13/h3-6,13-14H,2,7-8H2,1H3/b12-9+
InChIKeyANDYNETYUQGRMY-FMIVXFBMSA-N
MW320.85 g/mol
LogP1.01
Rot. Bonds5

About 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol

3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol (PubChem CID 155523631) has the molecular formula C11H15NO2Te and a molecular weight of 320.85 g/mol. Its IUPAC name is 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol.

Molecular Properties

Compound Name3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol
PubChem CID155523631
Molecular FormulaC11H15NO2Te
Molecular Weight320.85 g/mol
Exact Mass323.02
IUPAC Name3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol
SMILESC/C(=N\O)c1ccc([Te]CCCO)cc1
InChIInChI=1S/C11H15NO2Te/c1-9(12-14)10-3-5-11(6-4-10)15-8-2-7-13/h3-6,13-14H,2,7-8H2,1H3/b12-9+
InChIKeyANDYNETYUQGRMY-FMIVXFBMSA-N
XLogP1.01
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.85
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol?
The IUPAC name of 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol (CID 155523631) is 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol.
What is the SMILES notation for 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol?
The canonical SMILES for 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol is C/C(=N\O)c1ccc([Te]CCCO)cc1.
What is the InChIKey of 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol?
The InChIKey is ANDYNETYUQGRMY-FMIVXFBMSA-N. The full InChI is InChI=1S/C11H15NO2Te/c1-9(12-14)10-3-5-11(6-4-10)15-8-2-7-13/h3-6,13-14H,2,7-8H2,1H3/b12-9+.
What are the key properties of 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol?
3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol has a molecular weight of 320.85 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]tellanylpropan-1-ol is sourced from PubChem (CID 155523631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).