2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide

C15H15BrN2O3 — CID 51209692

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCCOc1ccccc1
InChIInChI=1S/C15H15BrN2O3/c16-12-6-7-15(20)18(10-12)11-14(19)17-8-9-21-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,17,19)
InChIKeyTUHWMWSYZIBGJP-UHFFFAOYSA-N
MW351.20 g/mol
LogP1.81
Rot. Bonds6

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide (PubChem CID 51209692) has the molecular formula C15H15BrN2O3 and a molecular weight of 351.20 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide
PubChem CID51209692
Molecular FormulaC15H15BrN2O3
Molecular Weight351.20 g/mol
Exact Mass350.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCCOc1ccccc1
InChIInChI=1S/C15H15BrN2O3/c16-12-6-7-15(20)18(10-12)11-14(19)17-8-9-21-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,17,19)
InChIKeyTUHWMWSYZIBGJP-UHFFFAOYSA-N
XLogP1.81
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.20
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide
CID 119503564
(2S)-4-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]-2-hydroxybutanoic acid
CID 114006601
2-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]-N-propylacetamide
CID 78815021
methyl 7-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]heptanoate
CID 86979311
2-(4-bromophenoxy)-N-(3-phenoxypropyl)acetamide
CID 9245994
2-(9-oxoacridin-10-yl)-N-(2-phenoxyethyl)acetamide
CID 26024228
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-phenoxyethyl)acetamide
CID 27234230
2-(3-amino-1,2,4-triazol-1-yl)-N-(2-phenoxyethyl)acetamide
CID 55012849
2-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]pyridine-3-carboxylic acid
CID 63652158
2-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 120663762
2-(ethylamino)-N-(2-phenoxyethyl)acetamide
CID 60672813
2-(5-bromo-2-oxo-1-pyridinyl)-N-cyanoacetamide
CID 79194945

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide (CID 51209692) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide is O=C(Cn1cc(Br)ccc1=O)NCCOc1ccccc1.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide?
The InChIKey is TUHWMWSYZIBGJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3/c16-12-6-7-15(20)18(10-12)11-14(19)17-8-9-21-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,17,19).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide has a molecular weight of 351.20 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide is sourced from PubChem (CID 51209692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).