N-(2-(1-Adamantyl)ethyl)isonicotinamide 1-oxide hydrochloride

N-[2-(1-adamantyl)ethyl]-1-oxidopyridin-1-ium-4-carboxamide;hydrochloride

CAS: 61876-39-9

Molecular Formula	`C18H25ClN2O2`
Molecular Weight	336.9 g/mol
Topological Polar Surface Area	54.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	4
Exact Mass	336.16046
Heavy Atoms	23
Complexity	388.0

Chemical Identifiers

CAS Number	61876-39-9
SMILES	`C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=CC=[N+](C=C4)[O-].Cl`
InChIKey	`WGWFHDMUJQZGDB-UHFFFAOYSA-N`

📖 Product Overview

N-(2-(1-Adamantyl)ethyl)isonicotinamide 1-oxide hydrochloride (CAS: 61876-39-9) is a chemical compound with molecular formula C18H25ClN2O2 and molecular weight 336.9 g/mol. Its IUPAC systematic name is N-[2-(1-adamantyl)ethyl]-1-oxidopyridin-1-ium-4-carboxamide;hydrochloride. Topological Polar Surface Area 54.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 4 Exact Mass 336.16046 Heavy Atoms 23 Complexity 388.0 InChI Key: WGWFHDMUJQZGDB-UHFFFAOYSA-N. SMILES: C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=CC=[N+](C=C4)[O-].Cl.

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