Chemical ID: 5866545

c1ccc2c(c1)cc([nH]2)C(=O)NCCc3c[nH]c4c3cccc4
Chemical ID:
5866545
Name [?]:
N-[2-(1H-indol-3-yl)ethyl]-1H-indole-2-carboxamide
SMILES [?]:
c1ccc2c(c1)cc([nH]2)C(=O)NCCc3c[nH]c4c3cccc4
InChi [?]:
InChI=1/C19H17N3O/c23-19(18-11-13-5-1-3-7-16(13)22-18)20-10-9-14-12-21-17-8-4-2-6-15(14)17/h1-8,11-12,21-22H,9-10H2,(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,21,2,22,6,20,3,23,14,13,7,16,5,15,19,4,18,8,10,12,17,9,11/rA:23nCCCCCCCCNCONCCCCNCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;d10;s10;s12;s13;s14;d15;s16;s17;s15s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17N3O
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.6367
Area:523.905
Solvation:-2.46095
Coulombic:-46.4243
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:303.358
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.53
LogP (Chemaxon):3.54

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Descriptor Annotations

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