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

C10H13BrN2O3 — CID 43427918

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide
SMILESCC(O)CNC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C10H13BrN2O3/c1-7(14)4-12-9(15)6-13-5-8(11)2-3-10(13)16/h2-3,5,7,14H,4,6H2,1H3,(H,12,15)
InChIKeySPISNCIXMKBDCB-UHFFFAOYSA-N
MW289.13 g/mol
LogP0.11
Rot. Bonds4

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

2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide (PubChem CID 43427918) has the molecular formula C10H13BrN2O3 and a molecular weight of 289.13 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide
PubChem CID43427918
Molecular FormulaC10H13BrN2O3
Molecular Weight289.13 g/mol
Exact Mass288.01
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide
SMILESCC(O)CNC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C10H13BrN2O3/c1-7(14)4-12-9(15)6-13-5-8(11)2-3-10(13)16/h2-3,5,7,14H,4,6H2,1H3,(H,12,15)
InChIKeySPISNCIXMKBDCB-UHFFFAOYSA-N
XLogP0.11
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.13
LogP ≤ 50.11
H-Bond Donors ≤ 52
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-(2-hydroxypropyl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide (CID 43427918) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide is CC(O)CNC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide?
The InChIKey is SPISNCIXMKBDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O3/c1-7(14)4-12-9(15)6-13-5-8(11)2-3-10(13)16/h2-3,5,7,14H,4,6H2,1H3,(H,12,15).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-hydroxypropyl)acetamide has a molecular weight of 289.13 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 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-hydroxypropyl)acetamide is sourced from PubChem (CID 43427918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).