5,6-Dihydro-6-(1-pyrrolidinylmethyl)-8H-furo(2',3':4,5)pyrrolo(2,1-c)(1,4)oxazin-8-one
Basic information
- CAS
473808-88-7- Standard SMILES
O=C1OC(CN2CCCC2)Cn2c1cc1occc12- InChIKey
PWTQYATUDKDBEU-UHFFFAOYSA-N- Molecular formula
- C14H16N2O3
- Average molar mass
- 260.29 g/mol
- Monoisotopic mass
- 260.11609238
Names & identifiers
- Preferred name
- 5,6-Dihydro-6-(1-pyrrolidinylmethyl)-8H-furo(2',3':4,5)pyrrolo(2,1-c)(1,4)oxazin-8-one
- IUPAC
- 11-(pyrrolidin-1-ylmethyl)-5,10-dioxa-1-azatricyclo[6.4.0.02,6]dodeca-2(6),3,7-trien-9-one
- English name
- 6-(1-Pyrrolidinylmethyl)-5,6-dihydro-8H-furo[2',3':4,5]pyrrolo[2,1-c][1,4]oxazin-8-one
- Molecular formula
- C14H16N2O3
- Molecular weight
- 260.29
Names & synonyms
473808-88-75,6-Dihydro-6-(1-pyrrolidinylmethyl)-8H-furo(2',3':4,5)pyrrolo(2,1-c)(1,4)oxazin-8-one5,6-Dihydro-6-(1-pyrrolidinylmethyl)-8H-furo[2',3':4,5]pyrrolo[2,1-c][1,4]oxazin-8-oneRefChem:298648DTXSID2011267266-pyrrolidin-1-ylmethyl-4,5-dihydrofuro[2',3':4,5]pyrrolo[2,1-c][1,4]oxazin-8-one5,6-Dihydro-6-(1-pyrrolidinylmethyl)-8H-furo[2a(2),3a(2):4,5]pyrrolo[2,1-c][1,4]oxazin-8-one6-(1-PYRROLIDINYLMETHYL)-5,6-DIHYDRO-8H-FURO[2',3':4,5]PYRROLO[2,1-C][1,4]OXAZIN-8-ONE6-[(Pyrrolidin-1-yl)methyl]-5,6-dihydro-8H-furo[2',3':4,5]pyrrolo[2,1-c][1,4]oxazin-8-one8H-Furo[2′,3′:4,5]pyrrolo[2,1-c][1,4]oxazin-8-one, 5,6-dihydro-6-(1-pyrrolidinylmethyl)-
Database identifiers
- CAS
473808-88-7- PubChem CID
- 4243100
- DTXSID
DTXSID201126726
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Melting point
- 128 · 128-130 °C(Solvent: Methanol)
- Boiling point
- 450.928 · 450.928±35.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.48 · 1.480±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
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Compound notes
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