2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide

C11H15BrN2O3 — CID 60754073

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-2-13(5-6-15)11(17)8-14-7-9(12)3-4-10(14)16/h3-4,7,15H,2,5-6,8H2,1H3
InChIKeyXFYZWQURBYAZQP-UHFFFAOYSA-N
MW303.16 g/mol
LogP0.45
Rot. Bonds5

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

2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide (PubChem CID 60754073) has the molecular formula C11H15BrN2O3 and a molecular weight of 303.16 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide
PubChem CID60754073
Molecular FormulaC11H15BrN2O3
Molecular Weight303.16 g/mol
Exact Mass302.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide
SMILESCCN(CCO)C(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-2-13(5-6-15)11(17)8-14-7-9(12)3-4-10(14)16/h3-4,7,15H,2,5-6,8H2,1H3
InChIKeyXFYZWQURBYAZQP-UHFFFAOYSA-N
XLogP0.45
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide (CID 60754073) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide is CCN(CCO)C(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
The InChIKey is XFYZWQURBYAZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O3/c1-2-13(5-6-15)11(17)8-14-7-9(12)3-4-10(14)16/h3-4,7,15H,2,5-6,8H2,1H3.
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-ethyl-N-(2-hydroxyethyl)acetamide has a molecular weight of 303.16 g/mol, XLogP of 0.45, 5 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-ethyl-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 60754073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).