Salsolidine

C12H17NO2 — CID 164752

IUPAC(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
SMILESC[C@H]1C2=CC(=C(C=C2CCN1)OC)OC
InChIInChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3/t8-/m0/s1
InChIKeyHMYJLVDKPJHJCF-QMMMGPOBSA-N
MW207.27 g/mol
LogP1.70
Rot. Bonds2

About Salsolidine

Salsolidine (PubChem CID 164752) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is (1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline.

Molecular Properties

Compound NameSalsolidine
PubChem CID164752
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name(1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
SMILESC[C@H]1C2=CC(=C(C=C2CCN1)OC)OC
InChIInChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3/t8-/m0/s1
InChIKeyHMYJLVDKPJHJCF-QMMMGPOBSA-N
XLogP1.70
TPSA30.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity210

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze Salsolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Emetine
CID 10219
Emetine Hydrochloride
CID 6603320
Tetrabenazine
CID 6018
(-)-Tetrahydropalmatine
CID 72301
Laudanosine
CID 73397
Reticuline
CID 439653
6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydro-isoquinoline
CID 27694
6,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline
CID 15623
Cephaeline
CID 442195
Deutetrabenazine
CID 73442840
Drotaverine
CID 1712095
(RS)-Salsolinol
CID 54456

Frequently Asked Questions

What is the IUPAC name of Salsolidine?
The IUPAC name of Salsolidine (CID 164752) is (1S)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline.
What is the SMILES notation for Salsolidine?
The canonical SMILES for Salsolidine is C[C@H]1C2=CC(=C(C=C2CCN1)OC)OC.
What is the InChIKey of Salsolidine?
The InChIKey is HMYJLVDKPJHJCF-QMMMGPOBSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3/t8-/m0/s1.
What are the key properties of Salsolidine?
Salsolidine has a molecular weight of 207.27 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Salsolidine is sourced from PubChem (CID 164752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).