Home Other Building Blocks 2-[(dimethyl-1H-1,2,4-triazol-1-yl)methyl]piperidine

2-[(dimethyl-1H-1,2,4-triazol-1-yl)methyl]piperidine

CAS No.:
1248974-19-7
Catalog Number:
AG01ABC9
Molecular Formula:
C10H18N4
Molecular Weight:
194.2767
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Product Description
Catalog Number:
AG01ABC9
Chemical Name:
2-[(dimethyl-1H-1,2,4-triazol-1-yl)methyl]piperidine
CAS Number:
1248974-19-7
Molecular Formula:
C10H18N4
Molecular Weight:
194.2767
MDL Number:
MFCD16075594
IUPAC Name:
2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]piperidine
InChI:
InChI=1S/C10H18N4/c1-8-12-9(2)14(13-8)7-10-5-3-4-6-11-10/h10-11H,3-7H2,1-2H3
InChI Key:
INDKHEXXHYDJLL-UHFFFAOYSA-N
SMILES:
Cc1nn(c(n1)C)CC1CCCCN1
Properties
Complexity:
185  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.153g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.282g/mol
Monoisotopic Mass:
194.153g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties