Chemical ID: 5576151

CC(=O)NC1Cc2c1cccc2
Chemical ID:
5576151
Name [?]:
N-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)acetamide
SMILES [?]:
CC(=O)NC1Cc2c1cccc2
InChi [?]:
InChI=1/C10H11NO/c1-7(12)11-10-6-8-4-2-3-5-9(8)10/h2-5,10H,6H2,1H3,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,11,10,12,9,6,2,7,8,5,4,3/rA:12cCCONCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s5s7;d8;s9;d10;d7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11NO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.43707
Area:332.864
Solvation:-1.88453
Coulombic:-20.7934
Bond Count [?]
All:13
Single:9
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:161.2
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.37
LogP (Chemaxon):1.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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