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

CAS: 72469-14-8

Molecular Formula	`C18H26N2O2`
Molecular Weight	302.4 g/mol
LogP	2.8
Topological Polar Surface Area	41.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	302.19943
Heavy Atoms	22
Complexity	379.0

Chemical Identifiers

CAS Number	72469-14-8
SMILES	`CN1CCC2C(C1)CCCC2NC(=O)C3=CC=C(C=C3)OC`
InChIKey	`IBOKCPCSTRHEMU-IYNBXCLQSA-N`

📖 Product Overview

N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-methoxybenzamide (CAS: 72469-14-8) is a chemical compound with molecular formula C18H26N2O2 and molecular weight 302.4 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-methoxybenzamide. LogP 2.8 Topological Polar Surface Area 41.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 302.19943 Heavy Atoms 22 Complexity 379.0 InChI Key: IBOKCPCSTRHEMU-IYNBXCLQSA-N. SMILES: CN1CCC2C(C1)CCCC2NC(=O)C3=CC=C(C=C3)OC.

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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-methoxybenzamide.

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