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Phenatine

HCID 120640
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Basic information

CAS
139-68-4
Standard SMILES
CC(Cc1ccccc1)NC(=O)c1cccnc1
InChIKey
KJRJJAZBUWXZFN-UHFFFAOYSA-N
Molecular formula
C15H16N2O
Average molar mass
240.3 g/mol
Monoisotopic mass
240.12626314

Names & identifiers

Preferred name
Phenatine
IUPAC
N-(1-phenylpropan-2-yl)pyridine-3-carboxamide
English name
Phenatine
Molecular formula
C15H16N2O
Molecular weight
240.3

Names & synonyms

PhenatinePervitonFenatin139-68-4N-(alpha-Methylphenethyl)nicotinamideNicotinoyl-beta-phenylisopropylamineNSC-5363990O34W851ERefChem:172623Nicotinoyl-.beta.-phenylisopropylamine3-Pyridinecarboxamide, N-(1-methyl-2-phenylethyl)-Phenatin
Show more names
N-(1-methyl-2-phenyl-ethyl)nicotinamideN-(1-phenylpropan-2-yl)pyridine-3-carboxamideN-(1-Methyl-2-phenylethyl)-3-pyridinecarboxamide
N-(.alpha.-Methylphenethyl)nicotinamideN-(1-Methyl-2-phenylethyl)nicotinamideNicotinic acid .beta.-phenylisopropylamideNicotinamide, N-(.alpha.-methylphenethyl)-UNII-90O34W851ENicotinamide, N-(alpha-methylphenethyl)-PHENATINE [MI]Oprea1_859298

Database identifiers

CAS
139-68-4
PubChem CID
120640
DTXSID
DTXSID40930271
UNII
90O34W851E
Nikkaji
J5.646D

Properties

Computed structural propertiesFilling in

XLogP
2.2
Topological polar surface area
42 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
261

Physicochemical properties

Melting point
99 · 99-100°
FDA UNII
90 O34W851E · 90O34W851E

Chemistry & industry

Pharmacology

MeSH Pharmacological ClassificationDrugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists. Classical antihistaminics block the histamine H1 receptors only.

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Compound notes

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