N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

C12H13BrN4O3 — CID 71861292

IUPACN-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCc1noc(COCC(=O)Nc2cc(C)c(Br)cn2)n1
InChIInChI=1S/C12H13BrN4O3/c1-7-3-10(14-4-9(7)13)16-11(18)5-19-6-12-15-8(2)17-20-12/h3-4H,5-6H2,1-2H3,(H,14,16,18)
InChIKeyONZZPKRAVSGZOD-UHFFFAOYSA-N
MW341.17 g/mol
LogP2.00
Rot. Bonds5

About N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (PubChem CID 71861292) has the molecular formula C12H13BrN4O3 and a molecular weight of 341.17 g/mol. Its IUPAC name is N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
PubChem CID71861292
Molecular FormulaC12H13BrN4O3
Molecular Weight341.17 g/mol
Exact Mass340.02
IUPAC NameN-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESCc1noc(COCC(=O)Nc2cc(C)c(Br)cn2)n1
InChIInChI=1S/C12H13BrN4O3/c1-7-3-10(14-4-9(7)13)16-11(18)5-19-6-12-15-8(2)17-20-12/h3-4H,5-6H2,1-2H3,(H,14,16,18)
InChIKeyONZZPKRAVSGZOD-UHFFFAOYSA-N
XLogP2.00
TPSA90.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.17
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide with MolForge

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Related Compounds

N-(3-bromo-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
CID 71863827
N-(5-bromo-6-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
CID 71985280
1-Morpholin-4-yl-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538366
N-cyclohexyl-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
CID 75538367
1-(4-Methylpiperazin-1-yl)-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538377
2-[(3-Pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]-1-pyrrolidin-1-ylethanone
CID 75538384
1-Piperidin-1-yl-2-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538390
Ethyl 3-pyridin-4-yl-1,2,4-oxadiazole-5-carboxylate
CID 16767420
4-[4-(5-Methyl-1,2,4-oxadiazol-3-YL)pyridin-2-YL]morpholine
CID 53133352
N-(5-bromo-4-methyl-2-pyridinyl)-2-(2-methoxyethoxy)acetamide
CID 71861291
Ethyl 3-[6-(diethylamino)pyridin-3-yl]-1,2,4-oxadiazole-5-carboxylate
CID 73253847
5-(2-Methoxypropan-2-yl)-3-pyridin-4-yl-1,2,4-oxadiazole
CID 91662480

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The IUPAC name of N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (CID 71861292) is N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.
What is the SMILES notation for N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The canonical SMILES for N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is Cc1noc(COCC(=O)Nc2cc(C)c(Br)cn2)n1.
What is the InChIKey of N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The InChIKey is ONZZPKRAVSGZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN4O3/c1-7-3-10(14-4-9(7)13)16-11(18)5-19-6-12-15-8(2)17-20-12/h3-4H,5-6H2,1-2H3,(H,14,16,18).
What are the key properties of N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide has a molecular weight of 341.17 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-4-methyl-2-pyridinyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is sourced from PubChem (CID 71861292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).