2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide

C11H16BrN3O3 — CID 104505729

IUPAC2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)Cn1cc(N)c(C)c(Br)c1=O
InChIInChI=1S/C11H16BrN3O3/c1-7-8(13)5-15(11(17)10(7)12)6-9(16)14-3-4-18-2/h5H,3-4,6,13H2,1-2H3,(H,14,16)
InChIKeyQQUUSASNQHFSKM-UHFFFAOYSA-N
MW318.17 g/mol
LogP0.26
Rot. Bonds5

About 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide

2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide (PubChem CID 104505729) has the molecular formula C11H16BrN3O3 and a molecular weight of 318.17 g/mol. Its IUPAC name is 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide
PubChem CID104505729
Molecular FormulaC11H16BrN3O3
Molecular Weight318.17 g/mol
Exact Mass317.04
IUPAC Name2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)Cn1cc(N)c(C)c(Br)c1=O
InChIInChI=1S/C11H16BrN3O3/c1-7-8(13)5-15(11(17)10(7)12)6-9(16)14-3-4-18-2/h5H,3-4,6,13H2,1-2H3,(H,14,16)
InChIKeyQQUUSASNQHFSKM-UHFFFAOYSA-N
XLogP0.26
TPSA86.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.17
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(cyclopropylmethyl)acetamide
CID 104505835
5-amino-3-bromo-1-(4-methoxybutyl)-4-methylpyridin-2-one
CID 104647609
2-(5-bromo-4-chloro-6-oxopyrimidin-1-yl)-N-(2-methoxyethyl)acetamide
CID 114583334
2-(5-bromo-4-chloro-6-oxopyrimidin-1-yl)-N-(3-methoxypropyl)acetamide
CID 114583701
N-(2-methoxyethyl)-2-(2-oxo-1H-imidazol-3-yl)acetamide
CID 103125914
2-[(5-amino-3-bromo-4-methyl-2-pyridinyl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 104506622
N-(2-methoxyethyl)-2-(4-methylpyrazol-1-yl)acetamide
CID 19526602
2-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-methoxyethyl)acetamide
CID 7886604
5-amino-3-bromo-1-(2,3-dihydroxypropyl)-4-methylpyridin-2-one
CID 104505895
3-amino-5-bromo-N-(2-methoxyethyl)-2-methylbenzamide
CID 107871969
N-(2-methoxyethyl)-2-(4,5,6,7-tetrahydrobenzimidazol-1-yl)acetamide
CID 115944319
2-[5-(4-amino-3-pyridinyl)imidazol-1-yl]-N-(2-methoxyethyl)acetamide
CID 114722000

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide (CID 104505729) is 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide is COCCNC(=O)Cn1cc(N)c(C)c(Br)c1=O.
What is the InChIKey of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide?
The InChIKey is QQUUSASNQHFSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O3/c1-7-8(13)5-15(11(17)10(7)12)6-9(16)14-3-4-18-2/h5H,3-4,6,13H2,1-2H3,(H,14,16).
What are the key properties of 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide?
2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide has a molecular weight of 318.17 g/mol, XLogP of 0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-3-bromo-4-methyl-2-oxo-1-pyridinyl)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 104505729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).