Chemical ID: 4555711

CN(C)C1CCCCNC1=O
Chemical ID:
4555711
Name [?]:
3-dimethylaminoazepan-2-one
SMILES [?]:
CN(C)C1CCCCNC1=O
InChi [?]:
InChI=1/C8H16N2O/c1-10(2)7-5-3-4-6-9-8(7)11/h7H,3-6H2,1-2H3,(H,9,11)
InChi Info:
AuxInfo=1/1/N:1,3,6,7,5,8,4,10,9,2,11/E:(1,2)/rA:11cCNCCCCCCNCO/rB:s1;s2;s2;s4;s5;s6;s7;s8;s4s9;d10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H16N2O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:5.44327
Area:306.324
Solvation:-2.21483
Coulombic:-26.0932
Bond Count [?]
All:11
Single:10
Double:1
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:156.226
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.2
LogP (Chemaxon):0.0

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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