7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride

C11H16ClNO2 — CID 162061488

IUPAC7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride
SMILESCOc1ccc2c(c1)CN(C)CC2O.Cl
InChIInChI=1S/C11H15NO2.ClH/c1-12-6-8-5-9(14-2)3-4-10(8)11(13)7-12;/h3-5,11,13H,6-7H2,1-2H3;1H
InChIKeyYZXBCJODKGYFTM-UHFFFAOYSA-N
MW229.71 g/mol
LogP1.60
Rot. Bonds1

About 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride

7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride (PubChem CID 162061488) has the molecular formula C11H16ClNO2 and a molecular weight of 229.71 g/mol. Its IUPAC name is 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride.

Molecular Properties

Compound Name7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride
PubChem CID162061488
Molecular FormulaC11H16ClNO2
Molecular Weight229.71 g/mol
Exact Mass229.09
IUPAC Name7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride
SMILESCOc1ccc2c(c1)CN(C)CC2O.Cl
InChIInChI=1S/C11H15NO2.ClH/c1-12-6-8-5-9(14-2)3-4-10(8)11(13)7-12;/h3-5,11,13H,6-7H2,1-2H3;1H
InChIKeyYZXBCJODKGYFTM-UHFFFAOYSA-N
XLogP1.60
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,7-dimethyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 138554110
2-methyl-7-phenylmethoxy-3,4-dihydro-1H-isoquinolin-4-ol
CID 91665585
7-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-5-ol
CID 122468703
(3aS,10bR)-8-methoxy-5-methyl-2,3,3a,4,6,10b-hexahydrofuro[3,2-d][2]benzazepine
CID 102165764
(4S)-7-methoxy-2-methyl-4-(3-methylphenyl)-3,4-dihydro-1H-isoquinoline
CID 71497003
7-methoxy-1,2,3,4-tetrahydroisoquinolin-4-ol;hydrochloride
CID 161060246
7-methoxy-2-methyl-4-pyridin-3-yl-3,4-dihydro-1H-isoquinoline
CID 66885817
6-methoxy-2-(2-sulfanylethyl)-3,4-dihydro-1H-isoquinolin-4-ol
CID 144821041
6-methoxy-1,2,3,4-tetrahydroisoquinolin-1-ol;hydrochloride
CID 90423697
5-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 122504635
7-methoxy-2,8-dimethyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 121000209
2,6-difluoro-4-(8-methoxy-2-methyl-1,3,4,5-tetrahydro-2-benzazepin-5-yl)phenol
CID 66964915

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride?
The IUPAC name of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride (CID 162061488) is 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride.
What is the SMILES notation for 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride?
The canonical SMILES for 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride is COc1ccc2c(c1)CN(C)CC2O.Cl.
What is the InChIKey of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride?
The InChIKey is YZXBCJODKGYFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2.ClH/c1-12-6-8-5-9(14-2)3-4-10(8)11(13)7-12;/h3-5,11,13H,6-7H2,1-2H3;1H.
What are the key properties of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride?
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride has a molecular weight of 229.71 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol;hydrochloride is sourced from PubChem (CID 162061488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).