2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide

C18H18N4O3 — CID 53141525

IUPAC2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(-c2nc(-c3ccccc3)no2)cccc1=O
InChIInChI=1S/C18H18N4O3/c1-12(2)19-15(23)11-22-14(9-6-10-16(22)24)18-20-17(21-25-18)13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,19,23)
InChIKeyAJBYLRUGXOEBSZ-UHFFFAOYSA-N
MW338.37 g/mol
LogP2.09
Rot. Bonds5

About 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide

2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide (PubChem CID 53141525) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide
PubChem CID53141525
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC Name2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(-c2nc(-c3ccccc3)no2)cccc1=O
InChIInChI=1S/C18H18N4O3/c1-12(2)19-15(23)11-22-14(9-6-10-16(22)24)18-20-17(21-25-18)13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,19,23)
InChIKeyAJBYLRUGXOEBSZ-UHFFFAOYSA-N
XLogP2.09
TPSA90.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1-pyridinyl]-N-propan-2-ylacetamide
CID 53141589
2-[2-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]-6-oxo-1-pyridinyl]-N-phenylacetamide
CID 53141559
2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]-N-phenylacetamide
CID 53141456
2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]-N-(4-methylphenyl)acetamide
CID 53141444
3-[3-(4-phenylphenyl)-1,2,4-oxadiazol-5-yl]-N-propan-2-ylpropanamide
CID 100762131
N-(4-bromophenyl)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]acetamide
CID 53141452
2-[4,6-dimethyl-2-oxo-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-(3-methylbutyl)acetamide
CID 53091156
2-(2-phenylbenzimidazol-1-yl)-N-propan-2-ylacetamide
CID 17032674
N-(2-ethylphenyl)-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrol-1-yl]acetamide
CID 75526974
N-[(2S)-butan-2-yl]-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 92729267
2-(2-oxo-11-phenyl-1,8,10,12-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),9,11-trien-8-yl)-N-propan-2-ylacetamide
CID 50753879
N-(3-methoxyphenyl)-2-[2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrol-1-yl]acetamide
CID 75526963

Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide (CID 53141525) is 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1c(-c2nc(-c3ccccc3)no2)cccc1=O.
What is the InChIKey of 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide?
The InChIKey is AJBYLRUGXOEBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-12(2)19-15(23)11-22-14(9-6-10-16(22)24)18-20-17(21-25-18)13-7-4-3-5-8-13/h3-10,12H,11H2,1-2H3,(H,19,23).
What are the key properties of 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide?
2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide has a molecular weight of 338.37 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-6-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-pyridinyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 53141525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).