CID 44735230
PubChem CID
44735230
Structure
Molecular Formula
Status
Non-live
Molecular Weight
405.6 g/mol
Dates
- Create:2010-03-14
Chemical Structure Depiction
N-(2,3-dimethylcyclohexyl)-2-(2-methylhexanoyl)-2,8-diazaspiro[4.5]decane-4-carboxamide
InChI=1S/C24H43N3O2/c1-5-6-8-18(3)23(29)27-15-20(24(16-27)11-13-25-14-12-24)22(28)26-21-10-7-9-17(2)19(21)4/h17-21,25H,5-16H2,1-4H3,(H,26,28)
UAROSVYKIBRFJR-UHFFFAOYSA-N
CCCCC(C)C(=O)N1CC(C2(C1)CCNCC2)C(=O)NC3CCCC(C3C)C
C24H43N3O2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
405.6 g/mol
Property Name
XLogP3-AA
Property Value
4.1
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
3
Property Name
Rotatable Bond Count
Property Value
6
Property Name
Exact Mass
Property Value
405.33552762 g/mol
Property Name
Monoisotopic Mass
Property Value
405.33552762 g/mol
Property Name
Topological Polar Surface Area
Property Value
61.4 A^2
Property Name
Heavy Atom Count
Property Value
29
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
572
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
5
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