Chemical ID: 5278148

CC(C(=O)OC)NC(=O)N1CCOCC1
Chemical ID:
5278148
Name [?]:
methyl 2-morpholinocarbonylaminopropanoate
SMILES [?]:
CC(C(=O)OC)NC(=O)N1CCOCC1
InChi [?]:
InChI=1/C9H16N2O4/c1-7(8(12)14-2)10-9(13)11-3-5-15-6-4-11/h7H,3-6H2,1-2H3,(H,10,13)
InChi Info:
AuxInfo=1/1/N:1,6,11,15,12,14,2,3,8,7,10,4,9,5,13/E:(3,4)(5,6)/rA:15cCCCOOCNCONCCOCC/rB:s1;s2;d3;s3;s5;s2;s7;d8;s8;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H16N2O4
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:6.25402
Area:397.204
Solvation:-3.67608
Coulombic:-56.6159
Bond Count [?]
All:15
Single:13
Double:2
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:216.234
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:-0.68
LogP (Chemaxon):-0.8

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue