Name: Name:4-(6-amino-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)butanenitrile
Brand: Angene
SKU: AG01B1GA
Rating: 90 (10 reviews)

4-(6-amino-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)butanenitrile

CAS No.:

1156903-10-4

Catalog Number:

AG01B1GA

Molecular Formula:

C13H15N3O

Molecular Weight:

229.2777

Catalog Number:

AG01B1GA

Chemical Name:

4-(6-amino-2-oxo-1,2,3,4-tetrahydroquinolin-1-yl)butanenitrile

CAS Number:

1156903-10-4

Molecular Formula:

C13H15N3O

Molecular Weight:

229.2777

MDL Number:

MFCD12411876

IUPAC Name:

4-(6-amino-2-oxo-3,4-dihydroquinolin-1-yl)butanenitrile

InChI:

InChI=1S/C13H15N3O/c14-7-1-2-8-16-12-5-4-11(15)9-10(12)3-6-13(16)17/h4-5,9H,1-3,6,8,15H2

InChI Key:

GMKLOALMVWSCTL-UHFFFAOYSA-N

SMILES:

N#CCCCN1C(=O)CCc2c1ccc(c2)N

Complexity:

333

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

229.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

229.283g/mol

Monoisotopic Mass:

229.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6