CID 44747163
PubChem CID
44747163
Structure
Molecular Formula
Status
Non-live
Molecular Weight
365.5 g/mol
Dates
- Create:2010-03-14
Chemical Structure Depiction
5-[[2-(cyclobutanecarbonyl)-2,8-diazaspiro[4.5]decane-4-carbonyl]amino]pentanoic acid
InChI=1S/C19H31N3O4/c23-16(24)6-1-2-9-21-17(25)15-12-22(18(26)14-4-3-5-14)13-19(15)7-10-20-11-8-19/h14-15,20H,1-13H2,(H,21,25)(H,23,24)
YZGCQIZNZYITQX-UHFFFAOYSA-N
C1CC(C1)C(=O)N2CC(C3(C2)CCNCC3)C(=O)NCCCCC(=O)O
C19H31N3O4
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
365.5 g/mol
Property Name
XLogP3-AA
Property Value
-2.1
Property Name
Hydrogen Bond Donor Count
Property Value
3
Property Name
Hydrogen Bond Acceptor Count
Property Value
5
Property Name
Rotatable Bond Count
Property Value
7
Property Name
Exact Mass
Property Value
365.23145648 g/mol
Property Name
Monoisotopic Mass
Property Value
365.23145648 g/mol
Property Name
Topological Polar Surface Area
Property Value
98.7 A^2
Property Name
Heavy Atom Count
Property Value
26
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
541
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
1
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