N-cyclopropylmethyl-3,11c-ethano-10-methoxy-1,2,3,3a,11b,11c-hexahydroaporphine
Basic information
- CAS
131927-74-7- Standard SMILES
COc1ccc2c(c1)C1CCC3CCC14C3CCN(CC1CC1)C4C2.Cl- InChIKey
FVFINRULDBFSPR-UHFFFAOYSA-N- Molecular formula
- C23H32ClNO
- Average molar mass
- 374 g/mol
- Monoisotopic mass
- 373.2172423
Overview
structure given in first source; RN given refers to the HCl
Names & identifiers
- Preferred name
- N-cyclopropylmethyl-3,11c-ethano-10-methoxy-1,2,3,3a,11b,11c-hexahydroaporphine
- IUPAC
- 5-(cyclopropylmethyl)-11-methoxy-5-azapentacyclo[12.5.0.01,6.02,17.08,13]nonadeca-8(13),9,11-triene;hydrochloride
- English name
- N-cyclopropylmethyl-3,11c-ethano-10-methoxy-1,2,3,3a,11b,11c-hexahydroaporphine
- Molecular formula
- C23H31NO.ClH
- Molecular weight
- 373.96
Names & synonyms
Cpmhha131927-74-7N-Cyclopropylmethyl-3,11c-ethano-10-methoxy-1,2,3,3a,11b,11c-hexahydroaporphineRefChem:163176DTXSID209274075-(cyclopropylmethyl)-11-methoxy-5-azapentacyclo[12.5.0.01,6.02,17.08,13]nonadeca-8(13),9,11-triene;hydrochloride3,11c-Ethano-11cH-dibenzo(de,g)quinoline, 6-(cyclopropylmethyl)- 1,2,3,3a,4,5,6,6a,7,11b-decahydro-10-methoxy-, hydrochloride6-(Cyclopropylmethyl)-10-methoxy-1,2,3,3a,4,5,6,6a,7,11b-decahydro-3,11c-ethanodibenzo[de,g]quinoline--hydrogen chloride (1/1)
Database identifiers
- CAS
131927-74-7- PubChem CID
- 3036041
- DTXSID
DTXSID20927407
Properties
Computed structural properties
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 530
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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