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

C11H15BrN2O3 — CID 43427917

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-2-9(7-15)13-10(16)6-14-5-8(12)3-4-11(14)17/h3-5,9,15H,2,6-7H2,1H3,(H,13,16)
InChIKeyPZIMRXQGYHPSSD-UHFFFAOYSA-N
MW303.16 g/mol
LogP0.50
Rot. Bonds5

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

2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide (PubChem CID 43427917) 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-hydroxybutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide
PubChem CID43427917
Molecular FormulaC11H15BrN2O3
Molecular Weight303.16 g/mol
Exact Mass302.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide
SMILESCCC(CO)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O3/c1-2-9(7-15)13-10(16)6-14-5-8(12)3-4-11(14)17/h3-5,9,15H,2,6-7H2,1H3,(H,13,16)
InChIKeyPZIMRXQGYHPSSD-UHFFFAOYSA-N
XLogP0.50
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamido-2-oxo-1-pyridinyl)-N-(2-hydroxyethyl)acetamide
CID 24769798
2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
CID 103723268
2-(5-bromo-2-oxo-1-pyridinyl)-N-(3,3-difluoro-2-hydroxypropyl)acetamide
CID 103770135
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2,2-difluoro-3-hydroxypropyl)acetamide
CID 104857114
2-(5-bromo-2-oxopyridin-1(2H)-yl)-N-isopropylacetamide
CID 26217348
N-(1-hydroxypropan-2-yl)-6-oxo-1H-pyridine-2-carboxamide
CID 103846218
2-(5-bromo-2-oxo-1-pyridinyl)-N-propan-2-ylpropanamide
CID 166086144
N-[1-(2-hydroxyethyl)-2-oxo-3-pyridinyl]propanamide
CID 170387115
5-Bromo-3-(3-hydroxypropylamino)-1-methylpyridin-2-one
CID 170434757
2-(5-bromo-2-oxo-1,2-dihydropyridin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
CID 17448646
2-(5-bromo-2-oxo-1-pyridinyl)-N-[(2R)-1-methoxypropan-2-yl]acetamide
CID 25953943
2-(5-bromo-2-oxo-1-pyridinyl)-N-[(2S)-1-methoxypropan-2-yl]acetamide
CID 25953945

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide (CID 43427917) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide is CCC(CO)NC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide?
The InChIKey is PZIMRXQGYHPSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O3/c1-2-9(7-15)13-10(16)6-14-5-8(12)3-4-11(14)17/h3-5,9,15H,2,6-7H2,1H3,(H,13,16).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-hydroxybutan-2-yl)acetamide has a molecular weight of 303.16 g/mol, XLogP of 0.50, 5 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-(1-hydroxybutan-2-yl)acetamide is sourced from PubChem (CID 43427917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).