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Chemical ID: 5099517
Chemical ID:
5099517
Name [?]:
ethyl 4-amino-1-ethyl-piperidine-4-carboxylate
SMILES [?]:
CCN1CCC(CC1)(C(=O)OCC)N
InChi [?]:
InChI=1/C10H20N2O2/c1-3-12-7-5-10(11,6-8-12)9(13)14-4-2/h3-8,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,13,2,12,5,7,4,8,9,6,14,3,10,11/E:(5,6)(7,8)/rA:14nCCNCCCCCCOOCCN/rB:s1;s2;s3;s4;s5;s6;s3s7;s6;d9;s9;s11;s12;s6;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H20N2O2 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.60922 |
Area: | 386.01 |
Solvation: | -2.04103 |
Coulombic: | -36.4774 |
Bond Count [?]
All: | 14 |
Single: | 13 |
Double: | 1 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 200.278 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 0.13 |
LogP (Chemaxon): | -0.39 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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