Name: Name:6-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile
Brand: Angene
SKU: AG01A8DW
Rating: 90 (10 reviews)

6-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile

CAS No.:

910108-88-2

Catalog Number:

AG01A8DW

Molecular Formula:

C12H16N4

Molecular Weight:

216.2822

Catalog Number:

AG01A8DW

Chemical Name:

6-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile

CAS Number:

910108-88-2

Molecular Formula:

C12H16N4

Molecular Weight:

216.2822

MDL Number:

MFCD11169412

IUPAC Name:

6-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carbonitrile

InChI:

InChI=1S/C12H16N4/c1-15-5-2-6-16(8-7-15)12-4-3-11(9-13)10-14-12/h3-4,10H,2,5-8H2,1H3

InChI Key:

NHPUQCLXYUTUAT-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(nc1)N1CCCN(CC1)C

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

216.137g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

216.288g/mol

Monoisotopic Mass:

216.137g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2