Chemical ID: 4122263

CC1CCN(CC1)CC(=O)O
Chemical ID:
4122263
Name [?]:
2-(4-methyl-1-piperidyl)acetic acid
SMILES [?]:
CC1CCN(CC1)CC(=O)O
InChi [?]:
InChI=1/C8H15NO2/c1-7-2-4-9(5-3-7)6-8(10)11/h7H,2-6H2,1H3,(H,10,11)
InChi Info:
AuxInfo=1/1/N:1,3,7,4,6,8,2,9,5,10,11/E:(2,3)(4,5)(10,11)/rA:11nCCCCNCCCCOO/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;d9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H15NO2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.84461
Area:319.336
Solvation:-2.13878
Coulombic:-31.5158
Bond Count [?]
All:11
Single:10
Double:1
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:157.21
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.82
LogP (Chemaxon):-1.92

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