2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide

C11H15BrN2O2 — CID 26217349

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide
SMILESCC(C)(C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O2/c1-11(2,3)13-9(15)7-14-6-8(12)4-5-10(14)16/h4-6H,7H2,1-3H3,(H,13,15)
InChIKeyJIKFOMVQTSLHFS-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.53
Rot. Bonds2

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide (PubChem CID 26217349) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide
PubChem CID26217349
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide
SMILESCC(C)(C)NC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C11H15BrN2O2/c1-11(2,3)13-9(15)7-14-6-8(12)4-5-10(14)16/h4-6H,7H2,1-3H3,(H,13,15)
InChIKeyJIKFOMVQTSLHFS-UHFFFAOYSA-N
XLogP1.53
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-1-methyl-2-oxo-3-pyridinyl)propanamide
CID 71860154
N-(5-Bromo-1,2-dihydro-2-oxo-3-pyridinyl)acetamide
CID 22123056
2-(5-Bromo-2-oxopyridin-1(2H)-yl)-N-(2-cyano-3-methylbutan-2-yl)acetamide
CID 16265177
2-(5-bromo-2-oxo-1,2-dihydropyridin-1-yl)-N-(pentan-3-yl)acetamide
CID 47004415
2-(4-bromo-2-oxo-1-pyridinyl)-N-propylacetamide
CID 126837423
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-bromo-2-oxo-1,2-dihydropyridin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 37343395
N-[2-[(5-bromo-1-methyl-6-oxo-3-pyridinyl)amino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 71856491
2-(5-bromo-2-oxopyridin-1(2H)-yl)-N-isopropylacetamide
CID 26217348
2-(5-bromo-2-oxopyridin-1-yl)-N-ethylacetamide
CID 26217352
2-(5-bromo-2-oxopyridin-1(2H)-yl)-N-methylacetamide
CID 32890706

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide (CID 26217349) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide is CC(C)(C)NC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide?
The InChIKey is JIKFOMVQTSLHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-11(2,3)13-9(15)7-14-6-8(12)4-5-10(14)16/h4-6H,7H2,1-3H3,(H,13,15).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide has a molecular weight of 287.16 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-tert-butylacetamide is sourced from PubChem (CID 26217349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).