1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine

C12H18N2 — CID 84771640

IUPAC1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine
SMILESCC(N)c1cccc2c1CN(C)CC2
InChIInChI=1S/C12H18N2/c1-9(13)11-5-3-4-10-6-7-14(2)8-12(10)11/h3-5,9H,6-8,13H2,1-2H3
InChIKeyNRIZOXYURKPBIA-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.69
Rot. Bonds1

About 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine

1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine (PubChem CID 84771640) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine.

Molecular Properties

Compound Name1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine
PubChem CID84771640
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine
SMILESCC(N)c1cccc2c1CN(C)CC2
InChIInChI=1S/C12H18N2/c1-9(13)11-5-3-4-10-6-7-14(2)8-12(10)11/h3-5,9H,6-8,13H2,1-2H3
InChIKeyNRIZOXYURKPBIA-UHFFFAOYSA-N
XLogP1.69
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propan-1-amine
CID 84778035
3-amino-3-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propanoic acid
CID 84796972
1-(8-propan-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanethiol
CID 155043779
2-methyl-8-(trifluoromethyl)-3,4-dihydro-1H-isoquinoline
CID 59534446
1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)cyclopentan-1-amine
CID 84793990
2-methylsulfinyl-8-propan-2-yl-3,4-dihydro-1H-isoquinoline
CID 137382327
methane;2-methyl-3,4-dihydro-1H-isoquinoline
CID 161283116
2-methyl-3,4-dihydro-1H-isoquinoline-7,8-diamine
CID 10035152
(1R)-1-(1,1-dioxo-2,3-dihydro-1-benzothiophen-4-yl)ethanamine
CID 96776910
methanol;2-methyl-3,4-dihydro-1H-isoquinoline
CID 142001874
2-methyl-1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)propan-2-ol
CID 105474711
7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-8-amine
CID 84664224

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine?
The IUPAC name of 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine (CID 84771640) is 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine.
What is the SMILES notation for 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine?
The canonical SMILES for 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine is CC(N)c1cccc2c1CN(C)CC2.
What is the InChIKey of 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine?
The InChIKey is NRIZOXYURKPBIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9(13)11-5-3-4-10-6-7-14(2)8-12(10)11/h3-5,9H,6-8,13H2,1-2H3.
What are the key properties of 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine?
1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine has a molecular weight of 190.29 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3,4-dihydro-1H-isoquinolin-8-yl)ethanamine is sourced from PubChem (CID 84771640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).