Home Other Building Blocks 5-methyl-4-(piperidin-4-yl)-4H-1,2,4-triazol-3-amine hydroiodide

5-methyl-4-(piperidin-4-yl)-4H-1,2,4-triazol-3-amine hydroiodide

CAS No.:
1909320-34-8
Catalog Number:
AG01B2ER
Molecular Formula:
C8H16IN5
Molecular Weight:
309.1506
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Product Description
Catalog Number:
AG01B2ER
Chemical Name:
5-methyl-4-(piperidin-4-yl)-4H-1,2,4-triazol-3-amine hydroiodide
CAS Number:
1909320-34-8
Molecular Formula:
C8H16IN5
Molecular Weight:
309.1506
MDL Number:
MFCD29907402
IUPAC Name:
5-methyl-4-piperidin-4-yl-1,2,4-triazol-3-amine;hydroiodide
InChI:
InChI=1S/C8H15N5.HI/c1-6-11-12-8(9)13(6)7-2-4-10-5-3-7;/h7,10H,2-5H2,1H3,(H2,9,12);1H
InChI Key:
DUQFDMINUNSVTQ-UHFFFAOYSA-N
SMILES:
Cc1nnc(n1C1CCNCC1)N.I
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
309.155g/mol
Monoisotopic Mass:
309.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties