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

CAS: 72469-17-1

Molecular Formula	`C17H23FN2O`
Molecular Weight	290.38 g/mol
LogP	2.9
Topological Polar Surface Area	32.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	2
Exact Mass	290.17944
Heavy Atoms	21
Complexity	368.0

Chemical Identifiers

CAS Number	72469-17-1
SMILES	`CN1CCC2C(C1)CCCC2NC(=O)C3=CC=C(C=C3)F`
InChIKey	`ZXUXBBXHJDRZIY-CWSLVUQWSA-N`

📖 Product Overview

N-[(4aR,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl]-4-fluorobenzamide (CAS: 72469-17-1) is a chemical compound with molecular formula C17H23FN2O and molecular weight 290.38 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-fluorobenzamide. LogP 2.9 Topological Polar Surface Area 32.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 2 Exact Mass 290.17944 Heavy Atoms 21 Complexity 368.0 InChI Key: ZXUXBBXHJDRZIY-CWSLVUQWSA-N. SMILES: CN1CCC2C(C1)CCCC2NC(=O)C3=CC=C(C=C3)F.

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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

Scientific research papers and technical documentation supporting this product for informed procurement decisions.

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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-fluorobenzamide.

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