(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine

C12H17NOTe — CID 155564910

IUPAC(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine
SMILESCCCC[Te]c1cccc(/C(C)=N/O)c1
InChIInChI=1S/C12H17NOTe/c1-3-4-8-15-12-7-5-6-11(9-12)10(2)13-14/h5-7,9,14H,3-4,8H2,1-2H3/b13-10+
InChIKeyFMQYENYSVAOMNX-JLHYYAGUSA-N
MW318.87 g/mol
LogP2.43
Rot. Bonds5

About (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine

(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine (PubChem CID 155564910) has the molecular formula C12H17NOTe and a molecular weight of 318.87 g/mol. Its IUPAC name is (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine
PubChem CID155564910
Molecular FormulaC12H17NOTe
Molecular Weight318.87 g/mol
Exact Mass321.04
IUPAC Name(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine
SMILESCCCC[Te]c1cccc(/C(C)=N/O)c1
InChIInChI=1S/C12H17NOTe/c1-3-4-8-15-12-7-5-6-11(9-12)10(2)13-14/h5-7,9,14H,3-4,8H2,1-2H3/b13-10+
InChIKeyFMQYENYSVAOMNX-JLHYYAGUSA-N
XLogP2.43
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.87
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine?
The IUPAC name of (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine (CID 155564910) is (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine is CCCC[Te]c1cccc(/C(C)=N/O)c1.
What is the InChIKey of (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine?
The InChIKey is FMQYENYSVAOMNX-JLHYYAGUSA-N. The full InChI is InChI=1S/C12H17NOTe/c1-3-4-8-15-12-7-5-6-11(9-12)10(2)13-14/h5-7,9,14H,3-4,8H2,1-2H3/b13-10+.
What are the key properties of (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine?
(NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine has a molecular weight of 318.87 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[1-(3-butyltellanylphenyl)ethylidene]hydroxylamine is sourced from PubChem (CID 155564910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).