Chemical ID: 7096930

C1CCC(CC1)N(CC(=O)O)C2CCCCC2
Chemical ID:
7096930
Name [?]:
2-dicyclohexylaminoacetic acid
SMILES [?]:
C1CCC(CC1)N(CC(=O)O)C2CCCCC2
InChi [?]:
InChI=1/C14H25NO2/c16-14(17)11-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h12-13H,1-11H2,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,15,2,6,14,16,3,5,13,17,8,4,12,9,7,10,11/E:(1,2)(3,4,5,6)(7,8,9,10)(12,13)(16,17)/rA:17nCCCCCCNCCOOCCCCCC/rB:s1;s2;s3;s4;s1s5;s4;s7;s8;d9;s9;s7;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H25NO2
All Atoms:42
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.26798
Area:412.928
Solvation:-2.05521
Coulombic:-32.8929
Bond Count [?]
All:18
Single:17
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:239.354
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.1
LogP (Chemaxon):0.2

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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