Acetamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)-

HCID 33930
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Basic information

CAS
27536-05-6
Standard SMILES
CC(=O)Nc1cccc2c1CCN(C)C2
InChIKey
QBSCJGYBESVOAA-UHFFFAOYSA-N
Molecular formula
C12H16N2O
Average molar mass
204.27 g/mol
Monoisotopic mass
204.12626314

Names & identifiers

Preferred name
Acetamide, N-(1,2,3,4-tetrahydro-2-methylisoquinolin-5-yl)-
IUPAC
N-(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)acetamide
English name
N-(1,2,3,4-Tetrahydro-2-methylisoquinolin-5-yl)acetamide
Molecular formula
C12H16N2O
Molecular weight
204.27

Names & synonyms

27536-05-6BRN 0478637ACETAMIDE, N-(1,2,3,4-TETRAHYDRO-2-METHYLISOQUINOLIN-5-YL)-Isoquinoline, 1,2,3,4-tetrahydro-5-acetamido-2-methyl-DTXSID70181951RefChem:314884DTXCID10104442N-(2-Methyl-1,2,3,4-tetrahydroisoquinolin-5-yl)acetamideSCHEMBL6784777SCHEMBL9289909QBSCJGYBESVOAA-UHFFFAOYSA-NN-(1,2,3,4-tetrahydro-2-methyl-5-isoquinolinyl)-acetamide
Show more names
N-(1,2,3,4-Tetrahydro-2-methylisoquinolin-5-yl)acetamideAcetamide, N-(1,2,3,4-tetrahydro-2-methyl-5-isoquinolinyl)-

Database identifiers

CAS
27536-05-6
PubChem CID
33930
DTXSID
DTXSID70181951
Nikkaji
J33.438C

Properties

Computed structural properties

XLogP
1
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15

Physicochemical properties

Boiling point
375.3 · 375.3±42.0 °C(Predicted)
Density
1.132 · 1.132±0.06 g/cm3(Predicted)
pka
15.02 · 15.02±0.20(Predicted)

Related reactions

1 records
New reaction record

Compound notes

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