Chemical ID: 4665681

CC(C)(C)N1CCN(CC1)Cc2ccccc2
Chemical ID:
4665681
Name [?]:
1-benzyl-4-tert-butyl-piperazine
SMILES [?]:
CC(C)(C)N1CCN(CC1)Cc2ccccc2
InChi [?]:
InChI=1/C15H24N2/c1-15(2,3)17-11-9-16(10-12-17)13-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,15,14,16,13,17,7,9,6,10,11,12,2,8,5/E:(1,2,3)(5,6)(7,8)(9,10)(11,12)/rA:17nCCCCNCCNCCCCCCCCC/rB:s1;s2;s2;s2;s5;s6;s7;s8;s5s9;s8;s11;s12;d13;s14;d15;d12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.09782
Area:424.68
Solvation:-1.51918
Coulombic:-11.6397
Bond Count [?]
All:18
Single:15
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:232.365
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.72
LogP (Chemaxon):2.57

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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