CID 44306528
PubChem CID
44306528
Structure
Molecular Formula
Status
Non-live
Molecular Weight
270.33 g/mol
Dates
- Create:2009-11-19
Chemical Structure Depiction
(2S)-N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]azetidine-2-carboxamide
InChI=1S/C12H22N4O3/c1-7(2)5-9(11(18)15-6-10(13)17)16-12(19)8-3-4-14-8/h7-9,14H,3-6H2,1-2H3,(H2,13,17)(H,15,18)(H,16,19)/t8-,9?/m0/s1
OTUROCKRRMPNHB-IENPIDJESA-N
CC(C)CC(C(=O)NCC(=O)N)NC(=O)[C@@H]1CCN1
C12H22N4O3
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
270.33 g/mol
Property Name
XLogP3-AA
Property Value
-0.7
Property Name
Hydrogen Bond Donor Count
Property Value
4
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
7
Property Name
Exact Mass
Property Value
270.16919058 g/mol
Property Name
Monoisotopic Mass
Property Value
270.16919058 g/mol
Property Name
Topological Polar Surface Area
Property Value
113 A^2
Property Name
Heavy Atom Count
Property Value
19
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
357
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
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
Old substance
CONTENTS