Nicotinamide, N-(p-(1-adamantyl)phenyl)-, hydrochloride

HCID 64416

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Basic information

CAS: 61876-29-7
Standard SMILES: Cl.O=C(Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)c1cccnc1
InChIKey: GZSYXCFOSYOWAK-UHFFFAOYSA-N
Molecular formula: C22H25ClN2O
Average molar mass: 368.9 g/mol
Monoisotopic mass: 368.1655411

Names & identifiers

Preferred name: Nicotinamide, N-(p-(1-adamantyl)phenyl)-, hydrochloride
IUPAC: N-[4-(1-adamantyl)phenyl]pyridine-3-carboxamide;hydrochloride

Names & synonyms

Nicotinamide, N-(p-(1-adamantyl)phenyl)-, hydrochlorideN-(p-(1-Adamantyl)phenyl)nicotinamide hydrochloride61876-29-7DTXSID902108583-Pyridinecarboxamide, N-(4-tricyclo(3.3.1.1(sup 3,7))dec-1-ylphenyl)-, monohydrochlorideRefChem:365591DTXCID20133349N-[4-(Adamantan-1-yl)phenyl]pyridine-3-carboxamide--hydrogen chloride (1/1)

Database identifiers

CAS: 61876-29-7
PubChem CID: 64416
DTXSID: DTXSID90210858

Properties

Computed structural properties

Topological polar surface area: 42 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 26
Formal charge: 0
Complexity: 467

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