N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-methylbenzamide

CAS: 72469-15-9

Molecular Formula	`C18H26N2O`
Molecular Weight	286.4 g/mol
LogP	3.2
Topological Polar Surface Area	32.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	286.2045
Heavy Atoms	21
Complexity	362.0

Chemical Identifiers

CAS Number	72469-15-9
SMILES	`CC1=CC=C(C=C1)C(=O)NC2CCCC3C2CCN(C3)C`
InChIKey	`XSTDZAMTGIEXQR-YNPPLXCJSA-N`

📖 Product Overview

N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-methylbenzamide (CAS: 72469-15-9) is a chemical compound with molecular formula C18H26N2O and molecular weight 286.4 g/mol. Its IUPAC systematic name is N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-methylbenzamide. LogP 3.2 Topological Polar Surface Area 32.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 2 Exact Mass 286.2045 Heavy Atoms 21 Complexity 362.0 InChI Key: XSTDZAMTGIEXQR-YNPPLXCJSA-N. SMILES: CC1=CC=C(C=C1)C(=O)NC2CCCC3C2CCN(C3)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-methylbenzamide.

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