Chemical ID: 6326661

CCCCC(CC)C(=O)N1CCCCC1
Chemical ID:
6326661
Name [?]:
2-ethyl-1-(1-piperidyl)hexan-1-one
SMILES [?]:
CCCCC(CC)C(=O)N1CCCCC1
InChi [?]:
InChI=1/C13H25NO/c1-3-5-9-12(4-2)13(15)14-10-7-6-8-11-14/h12H,3-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,2,6,3,13,12,14,4,11,15,5,8,10,9/E:(7,8)(10,11)/rA:15cCCCCCCCCONCCCCC/rB:s1;s2;s3;s4;s5;s6;s5;d8;s8;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H25NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:8.80402
Area:411.715
Solvation:-1.48887
Coulombic:-17.665
Bond Count [?]
All:15
Single:14
Double:1
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:211.344
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.54
LogP (Chemaxon):2.96

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