N-ethyl-N-(2-ethylselanylphenyl)acetamide

C12H17NOSe — CID 102432026

IUPACN-ethyl-N-(2-ethylselanylphenyl)acetamide
SMILESCC[Se]c1ccccc1N(CC)C(C)=O
InChIInChI=1S/C12H17NOSe/c1-4-13(10(3)14)11-8-6-7-9-12(11)15-5-2/h6-9H,4-5H2,1-3H3
InChIKeyDJYDWUGSTWBYRD-UHFFFAOYSA-N
MW270.23 g/mol
LogP1.83
Rot. Bonds4

About N-ethyl-N-(2-ethylselanylphenyl)acetamide

N-ethyl-N-(2-ethylselanylphenyl)acetamide (PubChem CID 102432026) has the molecular formula C12H17NOSe and a molecular weight of 270.23 g/mol. Its IUPAC name is N-ethyl-N-(2-ethylselanylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(2-ethylselanylphenyl)acetamide
PubChem CID102432026
Molecular FormulaC12H17NOSe
Molecular Weight270.23 g/mol
Exact Mass271.05
IUPAC NameN-ethyl-N-(2-ethylselanylphenyl)acetamide
SMILESCC[Se]c1ccccc1N(CC)C(C)=O
InChIInChI=1S/C12H17NOSe/c1-4-13(10(3)14)11-8-6-7-9-12(11)15-5-2/h6-9H,4-5H2,1-3H3
InChIKeyDJYDWUGSTWBYRD-UHFFFAOYSA-N
XLogP1.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.23
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-ethylselanylphenyl)acetamide?
The IUPAC name of N-ethyl-N-(2-ethylselanylphenyl)acetamide (CID 102432026) is N-ethyl-N-(2-ethylselanylphenyl)acetamide.
What is the SMILES notation for N-ethyl-N-(2-ethylselanylphenyl)acetamide?
The canonical SMILES for N-ethyl-N-(2-ethylselanylphenyl)acetamide is CC[Se]c1ccccc1N(CC)C(C)=O.
What is the InChIKey of N-ethyl-N-(2-ethylselanylphenyl)acetamide?
The InChIKey is DJYDWUGSTWBYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOSe/c1-4-13(10(3)14)11-8-6-7-9-12(11)15-5-2/h6-9H,4-5H2,1-3H3.
What are the key properties of N-ethyl-N-(2-ethylselanylphenyl)acetamide?
N-ethyl-N-(2-ethylselanylphenyl)acetamide has a molecular weight of 270.23 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-ethylselanylphenyl)acetamide is sourced from PubChem (CID 102432026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).