Name: Name:[1-(5-AMINO-1H-[1,2,4]TRIAZOL-3-YL)-PIPERIDIN-4-YL]-CARBAMIC ACID TERT-BU+
Brand: Angene
SKU: AG01EJGY
Rating: 90 (10 reviews)

[1-(5-AMINO-1H-[1,2,4]TRIAZOL-3-YL)-PIPERIDIN-4-YL]-CARBAMIC ACID TERT-BU+

CAS No.:

1710674-46-6

Catalog Number:

AG01EJGY

Molecular Formula:

C12H22N6O2

Molecular Weight:

282.3421

Catalog Number:

AG01EJGY

Chemical Name:

[1-(5-AMINO-1H-[1,2,4]TRIAZOL-3-YL)-PIPERIDIN-4-YL]-CARBAMIC ACID TERT-BU+

CAS Number:

1710674-46-6

Molecular Formula:

C12H22N6O2

Molecular Weight:

282.3421

MDL Number:

MFCD26382028

IUPAC Name:

tert-butyl N-[1-(5-amino-1H-1,2,4-triazol-3-yl)piperidin-4-yl]carbamate

InChI:

InChI=1S/C12H22N6O2/c1-12(2,3)20-11(19)14-8-4-6-18(7-5-8)10-15-9(13)16-17-10/h8H,4-7H2,1-3H3,(H,14,19)(H3,13,15,16,17)

InChI Key:

CLKSQDBSAWMZFX-UHFFFAOYSA-N

SMILES:

O=C(OC(C)(C)C)NC1CCN(CC1)c1n[nH]c(n1)N

Complexity:

337

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.18g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.348g/mol

Monoisotopic Mass:

282.18g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

109A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4