Chemical ID: 5774378

CC1=CC2(CC(NC2=CC(=O)N)(C)C)C=CC1=O
Chemical ID:
5774378
Name [?]:
2-(3,3,7-trimethyl-8-oxo-2-azaspiro[4.5]deca-6,9-dien-1-ylidene)acetamide
SMILES [?]:
CC1=CC2(CC(NC2=CC(=O)N)(C)C)C=CC1=O
InChi [?]:
InChI=1/C14H18N2O2/c1-9-7-14(5-4-10(9)17)8-13(2,3)16-11(14)6-12(15)18/h4-7,16H,8H2,1-3H3,(H2,15,18)
InChi Info:
AuxInfo=1/1/N:1,13,14,16,15,9,3,5,2,17,8,10,6,4,12,7,18,11/E:(2,3)/rA:18cCCCCCCNCCCONCCCCCO/rB:s1;d2;s3;s4;s5;s6;s4s7;w8;s9;d10;s10;s6;s6;s4;d15;s2s16;d17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H18N2O2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:7.59742
Area:411.046
Solvation:-2.67872
Coulombic:-45.8145
Bond Count [?]
All:19
Single:14
Double:5
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:246.305
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:0.94
LogP (Chemaxon):-0.3

Name Annotations

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Descriptor Annotations

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