CID 28614817
PubChem CID
28614817
Structure
Molecular Formula
Status
Non-live
Molecular Weight
244.46 g/mol
Dates
- Create:2009-05-28
Chemical Structure Depiction
diethyl-[(4S)-4-[[(2S,3S)-3-methylpentan-2-yl]azaniumyl]pentyl]azanium
InChI=1S/C15H34N2/c1-7-13(4)15(6)16-14(5)11-10-12-17(8-2)9-3/h13-16H,7-12H2,1-6H3/p+2/t13-,14-,15-/m0/s1
UJRPGPIQMZPKIY-KKUMJFAQSA-P
CC[C@H](C)[C@H](C)[NH2+][C@@H](C)CCC[NH+](CC)CC
C15H36N2+2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
244.46 g/mol
Property Name
XLogP3-AA
Property Value
3.8
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
0
Property Name
Rotatable Bond Count
Property Value
10
Property Name
Exact Mass
Property Value
244.287849157 g/mol
Property Name
Monoisotopic Mass
Property Value
244.287849157 g/mol
Property Name
Topological Polar Surface Area
Property Value
21.1 A^2
Property Name
Heavy Atom Count
Property Value
17
Property Name
Formal Charge
Property Value
2
Property Name
Complexity
Property Value
166
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
3
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS