Chemical ID: 6340091

C1CC1NC(=O)C2CC=CCC2C(=O)O
Chemical ID:
6340091
Name [?]:
6-(cyclopropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
SMILES [?]:
C1CC1NC(=O)C2CC=CCC2C(=O)O
InChi [?]:
InChI=1/C11H15NO3/c13-10(12-7-5-6-7)8-3-1-2-4-9(8)11(14)15/h1-2,7-9H,3-6H2,(H,12,13)(H,14,15)
InChi Info:
AuxInfo=1/1/N:9,10,8,11,1,2,3,7,12,5,13,4,6,14,15/E:(5,6)(14,15)/rA:15cCCCNCOCCCCCCCOO/rB:s1;s1s2;s3;s4;d5;s5;s7;s8;d9;s10;s7s11;s12;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H15NO3
All Atoms:15
Heavy Atoms:15
Chiral Atoms:2
ZAP Information [?]
Total:6.66851
Area:368.886
Solvation:-2.55364
Coulombic:-46.5122
Bond Count [?]
All:16
Single:13
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:209.242
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.49
LogP (Chemaxon):0.56

Name Annotations

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Descriptor Annotations

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