Chemical ID: 3959448

COCCNCC(=O)N1CCCCCC1
Chemical ID:
3959448
Name [?]:
1-azepan-1-yl-2-(2-methoxyethylamino)ethanone
SMILES [?]:
COCCNCC(=O)N1CCCCCC1
InChi [?]:
InChI=1/C11H22N2O2/c1-15-9-6-12-10-11(14)13-7-4-2-3-5-8-13/h12H,2-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,13,11,14,4,10,15,3,6,7,5,9,8,2/E:(2,3)(4,5)(7,8)/rA:15nCOCCNCCONCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;s11;s12;s13;s9s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H22N2O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.26294
Area:411.911
Solvation:-4.03484
Coulombic:-31.8523
Bond Count [?]
All:15
Single:14
Double:1
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:214.305
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:0.17
LogP (Chemaxon):-0.08

Name Annotations

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Descriptor Annotations

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