Basic information
- Standard SMILES
O=C1NC2(CCN(Cc3ccccc3)CC2)Oc2ccccc21- InChIKey
NMFAHOKVZJFMHP-UHFFFAOYSA-N- Molecular formula
- C19H20N2O2
- Average molar mass
- 308.4 g/mol
Names & identifiers
- Preferred name
- 1'-benzylspiro[1,3-benzoxazine-2,4'-piperidin]-4(3H)-one
- IUPAC
- 1'-benzylspiro[3H-1,3-benzoxazine-2,4'-piperidine]-4-one
Names & synonyms
1'-benzylspiro[1,3-benzoxazine-2,4'-piperidin]-4(3H)-one54906-22-8NSC6650081'-benzylspiro[3H-1,3-benzoxazine-2,4'-piperidine]-4-oneMaybridge1_007500Spiro[2H-1,3-benzoxazine-2,4'-piperidin]-4(3H)-one, 1'-(phenylmethyl)-Oprea1_750017MLS000660453SCHEMBL3228167CHEMBL1725794HMS562M20NMFAHOKVZJFMHP-UHFFFAOYSA-N
Show more names
HMS2594G06HMS3382L16NSC842394AKOS004911367CCG-249193NSC-665008NSC-842394NCGC00477355-01
Database identifiers
- PubChem CID
- 379871
- ChEMBL
CHEMBL1725794
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 425
Related reactions
3 records
Compound notes
Loading…