Chemical ID: 5650649

CN1CCC(CC1)N2CCC(CC2)C(=O)O
Chemical ID:
5650649
Name [?]:
1-(1-methyl-4-piperidyl)piperidine-4-carboxylic acid
SMILES [?]:
CN1CCC(CC1)N2CCC(CC2)C(=O)O
InChi [?]:
InChI=1/C12H22N2O2/c1-13-6-4-11(5-7-13)14-8-2-10(3-9-14)12(15)16/h10-11H,2-9H2,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,10,12,4,6,3,7,9,13,11,5,14,2,8,15,16/E:(2,3)(4,5)(6,7)(8,9)(15,16)/rA:16nCNCCCCCNCCCCCCOO/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;s10;s11;s8s12;s11;d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22N2O2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.50643
Area:403.488
Solvation:-2.58075
Coulombic:-35.0988
Bond Count [?]
All:17
Single:16
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:226.315
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.38
LogP (Chemaxon):-2.64

Name Annotations

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Descriptor Annotations

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