Chemical ID: 6356827

CCCCCNC(=O)CCCC(=O)O
Chemical ID:
6356827
Name [?]:
5-oxo-5-pentylamino-pentanoic acid
SMILES [?]:
CCCCCNC(=O)CCCC(=O)O
InChi [?]:
InChI=1/C10H19NO3/c1-2-3-4-8-11-9(12)6-5-7-10(13)14/h2-8H2,1H3,(H,11,12)(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,10,9,11,5,7,12,6,8,13,14/E:(13,14)/rA:14nCCCCCNCOCCCCOO/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;s11;d12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H19NO3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.60786
Area:431.533
Solvation:-3.18046
Coulombic:-45.7234
Bond Count [?]
All:13
Single:11
Double:2
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:201.263
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.36
LogP (Chemaxon):1.01

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