Name: Name:tert-butyl 3-cyano-3-(piperazin-1-yl)azetidine-1-carboxylate
Brand: Angene
SKU: AG01B2EE
Rating: 90 (10 reviews)

tert-butyl 3-cyano-3-(piperazin-1-yl)azetidine-1-carboxylate

CAS No.:

1510918-82-7

Catalog Number:

AG01B2EE

Molecular Formula:

C13H22N4O2

Molecular Weight:

266.3394

Catalog Number:

AG01B2EE

Chemical Name:

tert-butyl 3-cyano-3-(piperazin-1-yl)azetidine-1-carboxylate

CAS Number:

1510918-82-7

Molecular Formula:

C13H22N4O2

Molecular Weight:

266.3394

MDL Number:

MFCD22867415

IUPAC Name:

tert-butyl 3-cyano-3-piperazin-1-ylazetidine-1-carboxylate

InChI:

InChI=1S/C13H22N4O2/c1-12(2,3)19-11(18)16-9-13(8-14,10-16)17-6-4-15-5-7-17/h15H,4-7,9-10H2,1-3H3

InChI Key:

ISBXHLYBBQDCJT-UHFFFAOYSA-N

SMILES:

N#CC1(CN(C1)C(=O)OC(C)(C)C)N1CCNCC1

Complexity:

395

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.174g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.345g/mol

Monoisotopic Mass:

266.174g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1