Pyrrolo[2,3-b]indol-5-ol, 1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethyl-, (3aS-cis)-

HCID 1250

Basic information

Standard SMILES
CN1CCC2(C)c3cc(O)ccc3N(C)C12
InChIKey
HKGWQUVGHPDEBZ-UHFFFAOYSA-N
Molecular formula
C13H18N2O
Average molar mass
218.29 g/mol

Names & identifiers

Preferred name
Pyrrolo[2,3-b]indol-5-ol, 1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethyl-, (3aS-cis)-
IUPAC
3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol

Names & synonyms

SCHEMBL150459CHEMBL2322559HKGWQUVGHPDEBZ-UHFFFAOYSA-NPyrrolo[2,3-b]indol-5-ol, 1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethyl-, (3aS-cis)-AKOS005597732NS000006611,3a,8-Trimethyl-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indol-5-ol #

Database identifiers

PubChem CID
1250
ChEMBL
CHEMBL2322559

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
26.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
16

Related reactions

3 records

Compound notes

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