CAS 504-24-5|4 aminopyridine|pyridin-4-amine|4-Aminopyridine 98%|Pyridin-4-amine|pyridin-4-amine|4-AMINOPYRIDINE|Fampridine|4-Pyridinamine, 4-Pyridylamine|gamma-Aminopyridine|Amino-4-Pyridine|4-pyri...

General Information

Structure

Molecular Formula

C₅H₆N₂

Molecular Mass

94.11454

Exact Mass

94.0530982

Charge

0

InChI

InChI=1S/C5H6N2/c6-5-1-3-7-4-2-5/h1-4H,(H2,6,7)

InChIKey

NUKYPUAOHBNCPY-UHFFFAOYSA-N

Canonic Smiles

Nc1ccncc1

Isomeric Smiles

n1ccc(cc1)N

Calculated Properties

JChem

LogD (pH = 7.4)

-0.97

LogD (pH = 5.5)

-1.06

Log P

-0.07

Rotatable Bonds

0

H Donor

1

H Acceptors

2

Lipinski's Rule of Five

true

Acid pKa

8.95

Polar Surface Area

38.91

Polarizability

9.62

Molar Refractivity

28.60

LOG S

0.04

Data Source

Academic Data

Data Source

Names and Identifiers

IUPAC Traditional name

4 aminopyridine

IUPAC name

pyridin-4-amine

Synonyms

4-Aminopyridine 98%Pyridin-4-aminepyridin-4-amine4-AMINOPYRIDINEFampridine4-Pyridinamine, 4-Pyridylaminegamma-AminopyridineAmino-4-Pyridine4-pyridinamine4-吡啶胺4-Pyridylamine氨吡啶对氨基吡啶4-氨基吡啶4AP4-AminopyridinePhillips 18614-PyridinylamineAvitrolNSC 15041NeurelanPyridine-4-ylamineγ-AminopyridineEL 970Ampyrap-AminopyridineDalfampridineVMI 10-34-Aminopyridine4-aminopyridinep-AminopyridineN07XX07gamma-Aminopyridine4-Pyridylamine4-APDalfampridine4-AminopyridineAvitrol4-Pyridinamine

API Name

Dalfampridine

International Nonproprietary Name (INN)

fampridinumfampridinefampridina

Brand Name

Ampyra

Names and Identifiers

Registration numbers

MDL Number

CAS Number

EC Number

Chemspider ID

CHEMBL

PubChem SID

24862717248566772489128516207694724398105

Beilstein Number

105782

Unique Ingredient Identifier

BH3B64OKL9

Wikipedia Title

4-AminopyridineDalfampridine

IUPHAR ligand ID

CHEBI ID

PubChem CID

MeSH Name

ATC CODE

KEGG ID

Merck Index

DrugBank ID

BRENDA Database

2.3.1.53.5.4.42.5.1.2

UniProt Database

O88943Q61762O88759

Drug Central Database

ACToR Database

KEGG DRUG Database

PPDB Database

MetaboLights Database

SureChEMBL Database

NMRShiftDB Database

PDBeChem Database

CompTox Database

BKMS React Database

BindingDB Database

BRENDA Ligand Database

13387

Reaxys Registry

105782

Registration numbers

Properties

Pharmacology Properties

Admin Routes

Oral

Bioavailability

96%

Legal Status

Rx-only (US)

Pregnancy Category

C (US)

Gene Information

mouse ... Kcna3(16491)rat ... Grin2a(24409)

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

MP Biomedicals

02150366

Purity: ~98%
Pink to red crystals

05213134

MP Biomedicals Rare Chemical collection

Wikipedia

4-Aminopyridine

Sigma Aldrich

A78403

Packaging
25, 100 g in poly bottle

275875

Packaging
1, 5 g in glass bottle

36687

Legal Information
PESTANAL is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH

TRC

D113500

Dalfampridine is used in characterizing subtypes of potassium channel, and has also been used to manage some of the symptoms of multiple sclerosis, and is indicated for symptomatic improvement of walking in adults with several variations of the disease. D

ChEBI

CHEBI:34385

An aromatic amine that is pyridine bearing a single amino substituent at position 4. An orphan drug in the US, it is used to improve walking in adults with multiple sclerosis.

Molecule Details

References

PubChem Literature

From Data Sources

• Wu, Z.Z., et al.: J. Biol. Chem., 284. 36453 (2006)

• Judge S., et al.: Pharmacol. Ther., 111, 224 (2006)

References

Bioactivity

PubChem BioAssay

Bioactivity

Molecule

ID:90092