3-Methyl-5-[1-(4-nitrophenyl)-4-piperidyl]-2,3-dihydro-1,3,4-oxadiazol-2-one

HCID 89650613
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Basic information

Standard SMILES
Cn1nc(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)oc1=O
InChIKey
JVYABEGSEFMLOW-UHFFFAOYSA-N
Molecular formula
C14H16N4O4
Average molar mass
304.3 g/mol

Names & identifiers

Preferred name
3-Methyl-5-[1-(4-nitrophenyl)-4-piperidyl]-2,3-dihydro-1,3,4-oxadiazol-2-one
IUPAC
3-methyl-5-[1-(4-nitrophenyl)piperidin-4-yl]-1,3,4-oxadiazol-2-one

Names & synonyms

SCHEMBL15058907JVYABEGSEFMLOW-UHFFFAOYSA-N3-methyl-5-[1-(4-nitrophenyl)-4-piperidyl]-2,3-dihydro-1,3,4-oxadiazol-2-one

Database identifiers

PubChem CID
89650613

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
91 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
22

Related reactions

2 records
New reaction record

Compound notes

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