Name: Name:4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile
Brand: Angene
SKU: AG00FAS3
Rating: 90 (10 reviews)

4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile

CAS No.:

693254-24-9

Catalog Number:

AG00FAS3

Molecular Formula:

C12H15N3

Molecular Weight:

201.2676

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Product Description

Catalog Number:

AG00FAS3

Chemical Name:

4,6-Dimethyl-2-(pyrrolidin-1-yl)nicotinonitrile

CAS Number:

693254-24-9

Molecular Formula:

C12H15N3

Molecular Weight:

201.2676

MDL Number:

MFCD04209734

IUPAC Name:

4,6-dimethyl-2-pyrrolidin-1-ylpyridine-3-carbonitrile

InChI:

InChI=1S/C12H15N3/c1-9-7-10(2)14-12(11(9)8-13)15-5-3-4-6-15/h7H,3-6H2,1-2H3

InChI Key:

AZAOVFIBBQKZDL-UHFFFAOYSA-N

SMILES:

N#Cc1c(C)cc(nc1N1CCCC1)C

Properties

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

201.127g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

201.273g/mol

Monoisotopic Mass:

201.127g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

39.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Properties