Chemical ID: 7244429

CC(C)(C)NC(=O)CN1CCN(CC1)C(=O)CNC
Chemical ID:
7244429
Name [?]:
2-[4-(2-methylaminoacetyl)piperazin-1-yl]-N-tert-butyl-acetamide
SMILES [?]:
CC(C)(C)NC(=O)CN1CCN(CC1)C(=O)CNC
InChi [?]:
InChI=1/C13H26N4O2/c1-13(2,3)15-11(18)10-16-5-7-17(8-6-16)12(19)9-14-4/h14H,5-10H2,1-4H3,(H,15,18)
InChi Info:
AuxInfo=1/1/N:1,3,4,19,10,14,11,13,17,8,6,15,2,18,5,9,12,7,16/E:(1,2,3)(5,6)(7,8)/rA:19nCCCCNCOCNCCNCCCOCNC/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s12;s9s13;s12;d15;s15;s17;s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H26N4O2
All Atoms:45
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.71515
Area:482.746
Solvation:-4.35351
Coulombic:-48.6534
Bond Count [?]
All:19
Single:17
Double:2
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:270.371
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:-0.75
LogP (Chemaxon):-1.48

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Descriptor Annotations

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