Chemical ID: 4168003

CC(Cc1c[nH]c2c1cccc2)N3C(=O)CCC3=O
Chemical ID:
4168003
Name [?]:
1-[2-(1H-indol-3-yl)-1-methyl-ethyl]pyrrolidine-2,5-dione
SMILES [?]:
CC(Cc1c[nH]c2c1cccc2)N3C(=O)CCC3=O
InChi [?]:
InChI=1/C15H16N2O2/c1-10(17-14(18)6-7-15(17)19)8-11-9-16-13-5-3-2-4-12(11)13/h2-5,9-10,16H,6-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,9,12,16,17,3,5,2,4,8,7,14,18,6,13,15,19/E:(6,7)(14,15)(18,19)/rA:19cCCCCCNCCCCCCNCOCCCO/rB:s1;s2;s3;d4;s5;s6;s4s7;d8;s9;d10;d7s11;s2;s13;d14;s14;s16;s13s17;d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16N2O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:6.75793
Area:402.03
Solvation:-3.29281
Coulombic:-33.9607
Bond Count [?]
All:21
Single:15
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:256.3
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.57
LogP (Chemaxon):2.01

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Descriptor Annotations

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