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

C12H18N2 — CID 82279835

IUPAC2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine
SMILESCc1cccc2c1CN(CCN)CC2
InChIInChI=1S/C12H18N2/c1-10-3-2-4-11-5-7-14(8-6-13)9-12(10)11/h2-4H,5-9,13H2,1H3
InChIKeyWJJIGYYLVGXXOI-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.31
Rot. Bonds2

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

2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine (PubChem CID 82279835) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine
PubChem CID82279835
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine
SMILESCc1cccc2c1CN(CCN)CC2
InChIInChI=1S/C12H18N2/c1-10-3-2-4-11-5-7-14(8-6-13)9-12(10)11/h2-4H,5-9,13H2,1H3
InChIKeyWJJIGYYLVGXXOI-UHFFFAOYSA-N
XLogP1.31
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-aminoethyl)-3,4-dihydro-1H-isoquinolin-8-amine
CID 82581881
8-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid
CID 175983212
ethane;2-ethyl-5-methyl-3,4-dihydro-1H-isoquinoline
CID 162382873
1-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
CID 58777842
2-(8-methoxy-6-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine
CID 82279849
2-(2-aminoethyl)-1,3-dihydroisoindole-4-carboxylic acid
CID 164660426
ethane;5-methyl-2-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline
CID 143140384
2-(5-methyl-3,4-dihydro-1H-isoquinolin-2-yl)acetamide
CID 110456723
2-(2-aminoethyl)-6-methyl-4,5-dihydro-3H-2-benzazepin-1-one
CID 115030886
4-(3,4-dihydro-1H-isoquinolin-2-yl)butan-1-amine;hydrochloride
CID 68962885
3-(7-methyl-2,3-dihydroindol-1-yl)propan-1-amine
CID 83752989
2-[(3,4-dimethylphenyl)methyl]-3,4-dihydro-1H-isoquinolin-8-amine
CID 114521933

Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine?
The IUPAC name of 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine (CID 82279835) is 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine.
What is the SMILES notation for 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine?
The canonical SMILES for 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine is Cc1cccc2c1CN(CCN)CC2.
What is the InChIKey of 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine?
The InChIKey is WJJIGYYLVGXXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-10-3-2-4-11-5-7-14(8-6-13)9-12(10)11/h2-4H,5-9,13H2,1H3.
What are the key properties of 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine?
2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine has a molecular weight of 190.29 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanamine is sourced from PubChem (CID 82279835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).