Chemical ID: 6048457

CC(C)(C)OC(=O)N1CCC(CC1)CCN
Chemical ID:
6048457
Name [?]:
tert-butyl 4-(2-aminoethyl)piperidine-1-carboxylate
SMILES [?]:
CC(C)(C)OC(=O)N1CCC(CC1)CCN
InChi [?]:
InChI=1/C12H24N2O2/c1-12(2,3)16-11(15)14-8-5-10(4-7-13)6-9-14/h10H,4-9,13H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,14,10,12,15,9,13,11,6,2,16,8,7,5/E:(1,2,3)(5,6)(8,9)/rA:16nCCCCOCONCCCCCCCN/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s8s12;s11;s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H24N2O2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.03497
Area:426.321
Solvation:-1.62306
Coulombic:-42.101
Bond Count [?]
All:16
Single:15
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:228.331
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.64
LogP (Chemaxon):0.87

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Descriptor Annotations

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