7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine

C11H16N2O — CID 84664224

IUPAC7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
SMILESCOc1ccc2c(c1N)CN(C)CC2
InChIInChI=1S/C11H16N2O/c1-13-6-5-8-3-4-10(14-2)11(12)9(8)7-13/h3-4H,5-7,12H2,1-2H3
InChIKeyIZRLPFMFJMQTQK-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.27
Rot. Bonds1

About 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine

7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine (PubChem CID 84664224) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine.

Molecular Properties

Compound Name7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
PubChem CID84664224
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
SMILESCOc1ccc2c(c1N)CN(C)CC2
InChIInChI=1S/C11H16N2O/c1-13-6-5-8-3-4-10(14-2)11(12)9(8)7-13/h3-4H,5-7,12H2,1-2H3
InChIKeyIZRLPFMFJMQTQK-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-3,4-dihydro-1H-isoquinoline-7,8-diamine
CID 10035152
7,8-dimethoxy-11-methyl-17,19-dioxa-11-azatetracyclo[12.7.0.04,9.016,20]henicosa-1(21),4(9),5,7,14,16(20)-hexaene
CID 15765608
6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-amine
CID 59441854
8-amino-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-4-ol
CID 82395337
2-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propan-1-amine
CID 84778035
(13E)-3,4-dimethoxy-6-methyl-7,8-dihydro-5H-benzo[e][2]benzazecine
CID 102295748
7,8-dimethoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride
CID 23462892
8-methoxy-2-methyl-5-nitro-3,4-dihydro-1H-isoquinoline
CID 118465164
1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine
CID 84771640
7-chloro-2,8-dimethyl-3,4-dihydro-1H-isoquinoline
CID 84666615
2,8-dimethyl-3,4-dihydro-1H-isoquinoline-7-carbonitrile
CID 82405719
N-(8-bromo-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide
CID 21192937

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine?
The IUPAC name of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine (CID 84664224) is 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine.
What is the SMILES notation for 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine?
The canonical SMILES for 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine is COc1ccc2c(c1N)CN(C)CC2.
What is the InChIKey of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine?
The InChIKey is IZRLPFMFJMQTQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13-6-5-8-3-4-10(14-2)11(12)9(8)7-13/h3-4H,5-7,12H2,1-2H3.
What are the key properties of 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine?
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-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 7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine is sourced from PubChem (CID 84664224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).