2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide

C11H15BrN2O3 — CID 17448646

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-8(7-17-2)13-10(15)6-14-5-9(12)3-4-11(14)16/h3-5,8H,6-7H2,1-2H3,(H,13,15)
InChIKeySLWVMKOFXOWXQT-UHFFFAOYSA-N
MW303.16 g/mol
LogP0.76
Rot. Bonds5

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

2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 17448646) 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-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide
PubChem CID17448646
Molecular FormulaC11H15BrN2O3
Molecular Weight303.16 g/mol
Exact Mass302.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-8(7-17-2)13-10(15)6-14-5-9(12)3-4-11(14)16/h3-5,8H,6-7H2,1-2H3,(H,13,15)
InChIKeySLWVMKOFXOWXQT-UHFFFAOYSA-N
XLogP0.76
TPSA60.33 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 ≤ 50.76
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-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide (CID 17448646) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide is COCC(C)NC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is SLWVMKOFXOWXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O3/c1-8(7-17-2)13-10(15)6-14-5-9(12)3-4-11(14)16/h3-5,8H,6-7H2,1-2H3,(H,13,15).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 303.16 g/mol, XLogP of 0.76, 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-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 17448646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).