Cebranopadol
6-fluoro-N,N-dimethyl-1'-phenylspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-cyclohexane]-1'-amine
Molecular Identity
Cebranopadol
6-fluoro-N,N-dimethyl-1'-phenylspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-cyclohexane]-1'-amine
PubChem CID: 11848225
Cebranopadol is a member of indoles.
2D Structure
Properties
C24H27FN2O
Molecular Formula
378.50
Molecular Weight
g/mol
378.2107
Exact Mass
Da
4.3
XLogP
Drug-like (Lipinski: < 5)
28.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
553
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)C1(CCC2(CC1)C3=C(CCO2)C4=C(N3)C=CC(=C4)F)C5=CC=CC=C5Isomeric SMILES
SMILES: CN(C)C1(CCC2(CC1)C3=C(CCO2)C4=C(N3)C=CC(=C4)F)C5=CC=CC=C5Synonyms(20)
Cebranopadol863513-91-1GRT6005863513-93-3GRT-6005Cebranopadol ((1alpha,4alpha)stereoisomer)GRT 6005Cebranopadol ((1|A,4|A)stereoisomer)7GDW9S3GN3MFCD259767226-fluoro-N,N-dimethyl-1'-phenylspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-cyclohexane]-1'-amine(1r,4r)-6'-Fluoro-N,N-dimethyl-4-phenyl-4',9'-dihydro-3'H-spiro[cyclohexane-1,1'-pyrano[3,4-b]indol]-4-amineSpiro(cyclohexane-1,1'(3'h)-pyrano(3,4-b)indol)-4-amine, 6'-fluoro-4',9'-dihydro-n,N-dimethyl-4-phenyl-, trans-trans-6'-Fluoro-n,N-dimethyl-4-phenyl-4',9''-dihydro-3'h-spiro(cyclohexane-1,1'-pyrano(3,4-b)indol)-4-amineC24H27FN2O
Data from PubChem (NCBI)
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Drug Network
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