2-fluoro-N,N-dimethyl-2-phenylselanylacetamide

C10H12FNOSe — CID 11448324

IUPAC2-fluoro-N,N-dimethyl-2-phenylselanylacetamide
SMILESCN(C)C(=O)C(F)[Se]c1ccccc1
InChIInChI=1S/C10H12FNOSe/c1-12(2)10(13)9(11)14-8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyXLRNILDLULLLLM-UHFFFAOYSA-N
MW260.17 g/mol
LogP0.40
Rot. Bonds3

About 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide

2-fluoro-N,N-dimethyl-2-phenylselanylacetamide (PubChem CID 11448324) has the molecular formula C10H12FNOSe and a molecular weight of 260.17 g/mol. Its IUPAC name is 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide.

Molecular Properties

Compound Name2-fluoro-N,N-dimethyl-2-phenylselanylacetamide
PubChem CID11448324
Molecular FormulaC10H12FNOSe
Molecular Weight260.17 g/mol
Exact Mass261.01
IUPAC Name2-fluoro-N,N-dimethyl-2-phenylselanylacetamide
SMILESCN(C)C(=O)C(F)[Se]c1ccccc1
InChIInChI=1S/C10H12FNOSe/c1-12(2)10(13)9(11)14-8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyXLRNILDLULLLLM-UHFFFAOYSA-N
XLogP0.40
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 50.40
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 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide?
The IUPAC name of 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide (CID 11448324) is 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide.
What is the SMILES notation for 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide?
The canonical SMILES for 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide is CN(C)C(=O)C(F)[Se]c1ccccc1.
What is the InChIKey of 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide?
The InChIKey is XLRNILDLULLLLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNOSe/c1-12(2)10(13)9(11)14-8-6-4-3-5-7-8/h3-7,9H,1-2H3.
What are the key properties of 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide?
2-fluoro-N,N-dimethyl-2-phenylselanylacetamide has a molecular weight of 260.17 g/mol, XLogP of 0.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N-dimethyl-2-phenylselanylacetamide is sourced from PubChem (CID 11448324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).