Name: Name:(8aS)-2-benzyl-octahydropyrrolo[1,2-a]piperazin-7-one
Brand: Angene
SKU: AG01EJYV
Rating: 90 (10 reviews)

(8aS)-2-benzyl-octahydropyrrolo[1,2-a]piperazin-7-one

CAS No.:

1190946-29-2

Catalog Number:

AG01EJYV

Molecular Formula:

C14H18N2O

Molecular Weight:

230.3055

Catalog Number:

AG01EJYV

Chemical Name:

(8aS)-2-benzyl-octahydropyrrolo[1,2-a]piperazin-7-one

CAS Number:

1190946-29-2

Molecular Formula:

C14H18N2O

Molecular Weight:

230.3055

MDL Number:

MFCD31559426

IUPAC Name:

(8aS)-2-benzyl-1,3,4,6,8,8a-hexahydropyrrolo[1,2-a]pyrazin-7-one

InChI:

InChI=1S/C14H18N2O/c17-14-8-13-10-15(6-7-16(13)11-14)9-12-4-2-1-3-5-12/h1-5,13H,6-11H2/t13-/m0/s1

InChI Key:

ZPTXWXVQWSAOBA-ZDUSSCGKSA-N

SMILES:

O=C1CN2[C@@H](C1)CN(CC2)Cc1ccccc1

Complexity:

286

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.311g/mol

Monoisotopic Mass:

230.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2