Basic information
- CAS
54906-24-0- Standard SMILES
O=C1NC2(CCNCC2)Oc2ccccc21- InChIKey
XJHSSTMIDVOYQO-UHFFFAOYSA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Names & identifiers
- Preferred name
- Spiro[2H-1,3-benzoxazine-2,4'-piperidin]-4(3H)-one
- IUPAC
- spiro[3H-1,3-benzoxazine-2,4'-piperidine]-4-one
- English name
- Spiro[2H-1,3-benzoxazine-2,4'-piperidin]-4(3H)-one
- Molecular formula
- C12H14N2O2
- Molecular weight
- 218.25
Names & synonyms
54906-24-0Spiro[2H-1,3-benzoxazine-2,4'-piperidin]-4(3H)-oneSpiro[benzo[e][1,3]oxazine-2,4'-piperidin]-4(3H)-onespiro[3H-1,3-benzoxazine-2,4'-piperidine]-4-oneNSC6652763,4-dihydrospiro[1,3-benzoxazine-2,4'-piperidin]-4-onespiro[2H-1,3-benzoxazine-2,4'-piperidin]-4(3H)-one hydrochlorideOprea1_866780SCHEMBL552256CHEMBL1979664XJHSSTMIDVOYQO-UHFFFAOYSA-NDTXSID401229506
Show more names
spiro[1,3-benzoxazine-2,4'-piperidin]-4(3H)-one
ALBB-020191MFCD02182967AKOS004912308NSC-665276PS-0066ASN 12409094NCI60_022491DB-188913
Database identifiers
- CAS
54906-24-0- PubChem CID
- 379969
- DTXSID
DTXSID401229506- ChEMBL
CHEMBL1979664
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 287
Chemistry & industry
Suppliers3 total
上海凌飞医药科技有限公司15618928656 · [email protected]
上海珂臻医药科技有限公司021-021-021-31663258 13795219287 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
2 records
Compound notes
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