CAS 3430-27-1|3-Amino-4-methylpyridine|4-methylpyridin-3-amine|4-methylpyridin-3-amine|4-Methyl-pyridin-3-ylamine|3-氨基-4-甲基吡啶|4-Methyl-3-pyridinamine|3-Amino-4-methylpyridine|Ampic|3-Amino-4-p...

General Information

Structure

Molecular Formula

C₆H₈N₂

Molecular Mass

108.14112

Exact Mass

108.06874827

Charge

InChI

InChI=1S/C6H8N2/c1-5-2-3-8-4-6(5)7/h2-4H,7H2,1H3

InChIKey

IBKMZYWDWWIWEL-UHFFFAOYSA-N

Canonic Smiles

Cc1ccncc1N

Isomeric Smiles

c1c(c(ccn1)C)N

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-0.28974694

LogD (pH = 7.4)

0.39495692

Log P

0.4400688

Molar Refractivity

33.6427

Polarizability

12.333116

Polar Surface Area

38.91

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

3-Amino-4-methylpyridine4-Methyl-pyridin-3-ylamine3-氨基-4-甲基吡啶4-Methyl-3-pyridinamine3-Amino-4-methylpyridineAmpic3-Amino-4-picoline2-Amino-4-picoline4-methylpyridin-3-amine4-Methylpyridin-3-amine3-Amino-4-methylpyridine 98+%

IUPAC Traditional name

4-methylpyridin-3-amine

IUPAC name

4-methylpyridin-3-amine

Names and Identifiers

Registration numbers

CAS Number

MDL Number

PubChem CID

PubChem SID

Beilstein Number

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Sigma Aldrich

697141

Packaging
5, 25 g in glass bottle

Molecule Details

References

PubChem Literature

From Data Sources

• Tucker, T., et al.: J. Med. Chem., 51, 6503 (2007)

• Huang, H., et al.: Anal. Biochem., 363, 12 (2007)

• Ortho-lithiation with t-BuLi of the Boc-protected amine followed by addition of a Weinreb amide gave the 2-alkyl substituted 5-azaindole in good yield: J. Heterocycl. Chem., 29, 359 (1992), whereas DMF gave 6-azaindole in high yield: Synthesis, 877 (1996). 2-Substituted 6-azaindoles have also been synthesized in one step by direct dilithiation with s-BuLi, followed by reaction with an ester: J. Org, Chem., 70, 6512 (2005).

References

Bioactivity

PubChem BioAssay

Bioactivity