2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide

C11H10BrN3O3 — CID 71865270

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCc1ccon1
InChIInChI=1S/C11H10BrN3O3/c12-8-1-2-11(17)15(6-8)7-10(16)13-5-9-3-4-18-14-9/h1-4,6H,5,7H2,(H,13,16)
InChIKeyRBNSBUIDBPFBEC-UHFFFAOYSA-N
MW312.12 g/mol
LogP0.92
Rot. Bonds4

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide (PubChem CID 71865270) has the molecular formula C11H10BrN3O3 and a molecular weight of 312.12 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide
PubChem CID71865270
Molecular FormulaC11H10BrN3O3
Molecular Weight312.12 g/mol
Exact Mass310.99
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide
SMILESO=C(Cn1cc(Br)ccc1=O)NCc1ccon1
InChIInChI=1S/C11H10BrN3O3/c12-8-1-2-11(17)15(6-8)7-10(16)13-5-9-3-4-18-14-9/h1-4,6H,5,7H2,(H,13,16)
InChIKeyRBNSBUIDBPFBEC-UHFFFAOYSA-N
XLogP0.92
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.12
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide (CID 71865270) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide is O=C(Cn1cc(Br)ccc1=O)NCc1ccon1.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide?
The InChIKey is RBNSBUIDBPFBEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN3O3/c12-8-1-2-11(17)15(6-8)7-10(16)13-5-9-3-4-18-14-9/h1-4,6H,5,7H2,(H,13,16).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide has a molecular weight of 312.12 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1,2-oxazol-3-ylmethyl)acetamide is sourced from PubChem (CID 71865270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).