Chemical ID: 4123409

C1CN(CCC1C(=O)N)C(=O)C2CC=CCC2C(=O)O
Chemical ID:
4123409
Name [?]:
6-[(4-carbamoyl-1-piperidyl)carbonyl]cyclohex-3-ene-1-carboxylic acid
SMILES [?]:
C1CN(CCC1C(=O)N)C(=O)C2CC=CCC2C(=O)O
InChi [?]:
InChI=1/C14H20N2O4/c15-12(17)9-5-7-16(8-6-9)13(18)10-3-1-2-4-11(10)14(19)20/h1-2,9-11H,3-8H2,(H2,15,17)(H,19,20)
InChi Info:
AuxInfo=1/1/N:14,15,13,16,1,5,2,4,6,12,17,7,10,18,9,3,8,11,19,20/E:(5,6)(7,8)(19,20)/rA:20cCCNCCCCONCOCCCCCCCOO/rB:s1;s2;s3;s4;s1s5;s6;d7;s7;s3;d10;s10;s12;s13;d14;s15;s12s16;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20N2O4
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:7.17171
Area:443.031
Solvation:-3.90408
Coulombic:-65.807
Bond Count [?]
All:21
Single:17
Double:4
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:280.32
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:-0.72
LogP (Chemaxon):-0.41

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