N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide

C16H13BrN4O3 — CID 53141452

IUPACN-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide
SMILESCc1noc(-c2cccc(=O)n2CC(=O)Nc2ccc(Br)cc2)n1
InChIInChI=1S/C16H13BrN4O3/c1-10-18-16(24-20-10)13-3-2-4-15(23)21(13)9-14(22)19-12-7-5-11(17)6-8-12/h2-8H,9H2,1H3,(H,19,22)
InChIKeySGQFEHNFSNWRPI-UHFFFAOYSA-N
MW389.21 g/mol
LogP2.61
Rot. Bonds4

About N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide

N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide (PubChem CID 53141452) has the molecular formula C16H13BrN4O3 and a molecular weight of 389.21 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide
PubChem CID53141452
Molecular FormulaC16H13BrN4O3
Molecular Weight389.21 g/mol
Exact Mass388.02
IUPAC NameN-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide
SMILESCc1noc(-c2cccc(=O)n2CC(=O)Nc2ccc(Br)cc2)n1
InChIInChI=1S/C16H13BrN4O3/c1-10-18-16(24-20-10)13-3-2-4-15(23)21(13)9-14(22)19-12-7-5-11(17)6-8-12/h2-8H,9H2,1H3,(H,19,22)
InChIKeySGQFEHNFSNWRPI-UHFFFAOYSA-N
XLogP2.61
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.21
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]-N-(4-methylphenyl)acetamide
CID 53141444
2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]-N-phenylacetamide
CID 53141456
2-[2-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1-pyridinyl]-N-phenylacetamide
CID 53141559
2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide
CID 53141525
2-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1-pyridinyl]-N-propan-2-ylacetamide
CID 53141589
N-(4-bromophenyl)-2-[2-(3,5-dimethylanilino)-4-methyl-6-oxopyrimidin-1-yl]acetamide
CID 50928548
ethyl 4-[[2-[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-oxo-1-pyridinyl]acetyl]amino]benzoate
CID 53137161
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
2-[5-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-(4-methoxyphenyl)acetamide
CID 53365723
methyl 4-[[2-(2-methyl-6-oxo-1-pyridinyl)acetyl]amino]benzoate
CID 75366166
2-[5-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-(3-chloro-4-methylphenyl)acetamide
CID 51366710
2-(4-bromoanilino)-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 16624216

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide (CID 53141452) is N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide is Cc1noc(-c2cccc(=O)n2CC(=O)Nc2ccc(Br)cc2)n1.
What is the InChIKey of N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide?
The InChIKey is SGQFEHNFSNWRPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13BrN4O3/c1-10-18-16(24-20-10)13-3-2-4-15(23)21(13)9-14(22)19-12-7-5-11(17)6-8-12/h2-8H,9H2,1H3,(H,19,22).
What are the key properties of N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide?
N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide has a molecular weight of 389.21 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 53141452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).