Home Other Building Blocks 3-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine

3-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine

CAS No.:
1306558-43-9
Catalog Number:
AG01A5BQ
Molecular Formula:
C13H22N4
Molecular Weight:
234.3406
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Product Description
Catalog Number:
AG01A5BQ
Chemical Name:
3-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine
CAS Number:
1306558-43-9
Molecular Formula:
C13H22N4
Molecular Weight:
234.3406
MDL Number:
MFCD13431743
IUPAC Name:
3-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine
InChI:
InChI=1S/C13H22N4/c1-2-5-10(6-3-1)12-15-13(17-16-12)11-7-4-8-14-9-11/h10-11,14H,1-9H2,(H,15,16,17)
InChI Key:
KYUHNIBEFFCDOZ-UHFFFAOYSA-N
SMILES:
C1CCC(CC1)c1[nH]nc(n1)C1CCCNC1
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.184g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
234.347g/mol
Monoisotopic Mass:
234.184g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties