Basic information
- Standard SMILES
Cn1nc(C2CCN(c3ccc(N)cc3)CC2)oc1=O- InChIKey
JDQQWKJMBNNAEK-UHFFFAOYSA-N- Molecular formula
- C14H18N4O2
- Average molar mass
- 274.32 g/mol
Names & identifiers
- Preferred name
- 5-[1-(4-Aminophenyl)-4-piperidyl]-3-methyl-2,3-dihydro-1,3,4-oxadiazol-2-one
- IUPAC
- 5-[1-(4-aminophenyl)piperidin-4-yl]-3-methyl-1,3,4-oxadiazol-2-one
Names & synonyms
SCHEMBL15055790JDQQWKJMBNNAEK-UHFFFAOYSA-N5-[1-(4-aminophenyl)-4-piperidyl]-3 -methyl-2,3-dihydro-1,3,4-oxadiazol-2-one5-[1-(4-aminophenyl)-4-piperidyl]-3-methyl-2,3-dihydro-1,3,4-oxadiazol-2-one
Database identifiers
- PubChem CID
- 89648446
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 71.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 396
Related reactions
2 records
Compound notes
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