N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide

C7H7BrN2O2 — CID 22123056

IUPACN-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide
SMILESCC(=O)Nc1cc(Br)c[nH]c1=O
InChIInChI=1S/C7H7BrN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11)
InChIKeyDZPXAAPHBCJNCQ-UHFFFAOYSA-N
MW231.05 g/mol
LogP1.10
Rot. Bonds1

About N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide

N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide (PubChem CID 22123056) has the molecular formula C7H7BrN2O2 and a molecular weight of 231.05 g/mol. Its IUPAC name is N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide
PubChem CID22123056
Molecular FormulaC7H7BrN2O2
Molecular Weight231.05 g/mol
Exact Mass229.97
IUPAC NameN-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide
SMILESCC(=O)Nc1cc(Br)c[nH]c1=O
InChIInChI=1S/C7H7BrN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11)
InChIKeyDZPXAAPHBCJNCQ-UHFFFAOYSA-N
XLogP1.10
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.05
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Amino-5-bromo-1-methyl-1,2-dihydropyridin-2-one
CID 52911268
N-(5-bromo-1-methyl-2-oxo-3-pyridinyl)propanamide
CID 71860154
N-(2-hydroxypyridin-3-yl)prop-2-enamide
CID 156600118
3-amino-5-bromo-1H-pyridin-2-one
CID 13434515
6-hydroxy-N-(propan-2-yl)pyridine-2-carboxamide
CID 15334838
N-(2-Hydroxypyridin-3-yl)acetamide
CID 322049
2-(4-bromo-2-oxo-1-pyridinyl)-N-propylacetamide
CID 126837423
N-(5-fluoro-2-oxo-1H-pyridin-3-yl)acetamide
CID 138578529
3-(ethylamino)-5-fluoro-1H-pyridin-2-one
CID 142523723
N-(1-Methyl-2-oxo-1,2-dihydro-3-pyridinyl)acetamide
CID 326860
2-(5-Bromo-2-oxopyridin-1(2H)-yl)acetamide
CID 9317383
2-(5-amino-3-bromo-2-oxo-1-pyridinyl)-N-(2,2,2-trifluoroethyl)acetamide
CID 80501744

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide?
The IUPAC name of N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide (CID 22123056) is N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide.
What is the SMILES notation for N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide?
The canonical SMILES for N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide is CC(=O)Nc1cc(Br)c[nH]c1=O.
What is the InChIKey of N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide?
The InChIKey is DZPXAAPHBCJNCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrN2O2/c1-4(11)10-6-2-5(8)3-9-7(6)12/h2-3H,1H3,(H,9,12)(H,10,11).
What are the key properties of N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide?
N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide has a molecular weight of 231.05 g/mol, XLogP of 1.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-oxo-1H-pyridin-3-yl)acetamide is sourced from PubChem (CID 22123056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).