6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine

C11H16N2O — CID 59441854

IUPAC6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
SMILESCOc1cc2c(cc1N)CN(C)CC2
InChIInChI=1S/C11H16N2O/c1-13-4-3-8-6-11(14-2)10(12)5-9(8)7-13/h5-6H,3-4,7,12H2,1-2H3
InChIKeyXRHYBSPANQDMJG-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.27
Rot. Bonds1

About 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine

6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine (PubChem CID 59441854) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine.

Molecular Properties

Compound Name6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
PubChem CID59441854
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
SMILESCOc1cc2c(cc1N)CN(C)CC2
InChIInChI=1S/C11H16N2O/c1-13-4-3-8-6-11(14-2)10(12)5-9(8)7-13/h5-6H,3-4,7,12H2,1-2H3
InChIKeyXRHYBSPANQDMJG-UHFFFAOYSA-N
XLogP1.27
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-methyl-6-(trideuteriomethoxy)-3,4-dihydro-1H-isoquinolin-7-amine
CID 168846425
6-ethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
CID 134564645
2-methyl-6-(oxetan-3-yloxy)-3,4-dihydro-1H-isoquinolin-7-amine
CID 170029641
7,8-dimethoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride
CID 23462892
7-amino-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol
CID 84656604
3-methoxy-5,6,7,8-tetrahydronaphthalen-2-amine;hydrobromide
CID 170999674
6-ethyl-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
CID 134564878
7-methoxy-2-methyl-6-(piperazin-1-ylmethyl)-3,4-dihydro-1H-isoquinoline
CID 83956913
1-(6-amino-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-trifluoroethanone
CID 129048506
N-(6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)formamide
CID 167049883
8-amino-7-methoxy-3-sulfanyl-2,5-dihydro-1H-3-benzazepin-4-one
CID 143662042
6-methoxy-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-amine
CID 142365913

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine?
The IUPAC name of 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine (CID 59441854) is 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine.
What is the SMILES notation for 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine?
The canonical SMILES for 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine is COc1cc2c(cc1N)CN(C)CC2.
What is the InChIKey of 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine?
The InChIKey is XRHYBSPANQDMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13-4-3-8-6-11(14-2)10(12)5-9(8)7-13/h5-6H,3-4,7,12H2,1-2H3.
What are the key properties of 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine?
6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine has a molecular weight of 192.26 g/mol, XLogP of 1.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine is sourced from PubChem (CID 59441854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).