6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

C11H14FNO — CID 83377554

IUPAC6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
SMILESCOc1c(F)ccc2c1CCNC2C
InChIInChI=1S/C11H14FNO/c1-7-8-3-4-10(12)11(14-2)9(8)5-6-13-7/h3-4,7,13H,5-6H2,1-2H3
InChIKeyVGYAMNNLBVSSQG-UHFFFAOYSA-N
MW195.24 g/mol
LogP2.04
Rot. Bonds1

About 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline (PubChem CID 83377554) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline.

Molecular Properties

Compound Name6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
PubChem CID83377554
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
SMILESCOc1c(F)ccc2c1CCNC2C
InChIInChI=1S/C11H14FNO/c1-7-8-3-4-10(12)11(14-2)9(8)5-6-13-7/h3-4,7,13H,5-6H2,1-2H3
InChIKeyVGYAMNNLBVSSQG-UHFFFAOYSA-N
XLogP2.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline 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

6,7-dimethoxy-1-methyl-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 83691109
5-fluoro-4-methoxy-2,3-dihydro-1H-inden-1-amine
CID 55294576
1-methyl-1,2,3,4-tetrahydroisoquinoline-5,6-diamine
CID 84656202
6-chloro-5-fluoro-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochloride
CID 167716546
5-fluoro-6-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline;2-(2-fluoro-3-methoxyphenyl)ethanamine
CID 160708607
(1S)-7-bromo-5-fluoro-1-methyl-1,2,3,4-tetrahydroisoquinoline
CID 94418031
8-bromo-5-fluoro-1-methyl-1,2,3,4-tetrahydroisoquinoline
CID 63272678
methyl 8-fluoro-1-methyl-1,2,3,4-tetrahydroisoquinoline-5-carboxylate;hydrochloride
CID 170918020
(1S)-5-ethyl-1-methyl-1,2,3,4-tetrahydroisoquinoline
CID 94423264
6-bromo-1-methyl-1,2,3,4-tetrahydroisoquinolin-5-amine
CID 84702414
5-(1-fluoropropan-2-yl)-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydroxylamine
CID 145383424
1-(3,5-dichloro-2-methoxyphenyl)-5,6-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 3327080

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline?
The IUPAC name of 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline (CID 83377554) is 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline.
What is the SMILES notation for 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline?
The canonical SMILES for 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline is COc1c(F)ccc2c1CCNC2C.
What is the InChIKey of 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline?
The InChIKey is VGYAMNNLBVSSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-7-8-3-4-10(12)11(14-2)9(8)5-6-13-7/h3-4,7,13H,5-6H2,1-2H3.
What are the key properties of 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline?
6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline has a molecular weight of 195.24 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline is sourced from PubChem (CID 83377554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).