Chemical ID: 5100581

CC(=O)CC(=O)NC1CCCCCC1
Chemical ID:
5100581
Name [?]:
N-cycloheptyl-3-oxo-butanamide
SMILES [?]:
CC(=O)CC(=O)NC1CCCCCC1
InChi [?]:
InChI=1/C11H19NO2/c1-9(13)8-11(14)12-10-6-4-2-3-5-7-10/h10H,2-8H2,1H3,(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,11,12,10,13,9,14,4,2,8,5,7,3,6/E:(2,3)(4,5)(6,7)/rA:14nCCOCCONCCCCCCC/rB:s1;d2;s2;s4;d5;s5;s7;s8;s9;s10;s11;s12;s8s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H19NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:5.36218
Area:379.564
Solvation:-4.12692
Coulombic:-24.6553
Bond Count [?]
All:14
Single:12
Double:2
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:197.274
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.58
LogP (Chemaxon):1.6

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Descriptor Annotations

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